Project ID: plumID:20.029
Source: E2F1-DP1_PLUMED-NEST/MULTI_REPLICA/plumed-main.dat
Originally used with PLUMED version: 2.6
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr
#SETTINGS NATOMS=303032 #MOLINFO STRUCTURE=../aacg.pdb use this with gromacs #INCLUDE FILE=../plumed_beads.dat #INCLUDE FILE=../plumed-restraints.dat #INCLUDE FILE=../plumed-SAXS_12q.datMOLINFOThis command is used to provide information on the molecules that are present in your system. More detailsSTRUCTURE=aacg.pdba file in pdb format containing a reference structureWHOLEMOLECULESThis action is used to rebuild molecules that can become split by the periodic boundary conditions. More detailsENTITY0=1-2885,2885-1712:-1,6605-6945,6945-2886:-1,2886-3812,6946-7896the atoms that make up a molecule that you wish to alignINCLUDEIncludes an external input file, similar to #include in C preprocessor. More details. Show included fileFILE=plumed_beads.dat # The command: # INCLUDE FILE=plumed_beads.dat # ensures PLUMED loads the contents of the file called plumed_beads.dat # The contents of this file are shown below (click the red comment to hide them). bead1:file to be includedCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1,2,3,4,5,18,19the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,1,1,12,12,16 bead2:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7,10,13,14the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead3:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=20,21,22,29,30the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead4:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=24,27,28the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead5:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=31,41,43,44the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead6:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=32,35,38the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead7:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=45,46,47,50,51the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead8:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=52,53,54,65,66the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead9:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=56,59,62,63,64the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead10:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=67,68,69,87,88the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead11:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=71,74,77the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead12:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=80,83,84,85,86the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead13:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=89,90,91,98,99the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead14:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=93,96,97the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead15:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=100,101,102,122,123the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead16:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=104,107,110the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead17:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=113,114,115,116,119the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead18:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=124,125,126,143,144the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead19:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=128,131,132,133the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead20:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=139,140,141,142the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead21:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=134,135,136,137,138the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,16,1 bead22:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=145,146,147,158,159the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead23:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=149,152,155,156,157the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead24:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=160,161,162,172,173the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead25:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=164,166,170,171the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead26:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=174,175,176,183,184the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead27:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=178,181,182the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead28:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=185,186,187,202,203the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead29:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=189,192,194,198the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead30:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=204,205,206,216,217the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead31:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=208,211,212,213the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead32:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=218,219,220,235,236the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead33:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=222,225,227,231the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead34:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=237,238,239,249,250the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead35:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=241,243,247,248the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead36:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=251,252,253,263,264the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead37:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=255,257,261,262the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead38:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=265,266,267,285,286the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead39:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=269,272,275the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead40:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=278,281,282,283,284the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead41:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=287,288,289,309,310the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead42:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=291,294,297the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead43:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=300,301,302,303,306the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead44:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=311,312,313,329,330the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead45:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=315,318,319,320the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead46:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=325,326,327,328the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead47:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=321,322,323,324the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead48:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=331,332,333,348,349the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead49:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=335,338,340,344the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead50:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=350,351,352,363,364the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead51:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=354,357,360,361,362the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead52:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=365,366,367,382,383the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead53:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=369,372,374,378the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead54:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=384,385,386,401,402the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead55:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=388,391,393,397the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead56:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=403,404,405,412,413the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead57:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=407,410,411the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead58:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=414,415,416,429,430the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead59:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=418,421the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead60:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=425,426,427,428the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead61:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=422,423,424the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead62:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=431,432,433,440,441the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead63:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=435,438,439the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead64:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=442,443,444,446,450,451the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead65:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=452,453,454,462,463the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead66:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=456,459,460,461the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead67:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=464,465,466,469,470the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead68:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=471,472,473,485,486the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead69:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=475,477,481the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead70:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=487,488,489,501,502the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead71:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=491,493,497the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead72:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=503,504,505,513,514the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead73:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=507,510,511,512the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead74:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=515,516,517,532,533the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead75:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=519,522,524,528the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead76:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=534,535,536,546,547the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead77:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=538,541,542,543the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead78:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=548,549,550,570,571the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead79:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=552,555,569the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead80:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=556,557,558,559,560the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,14,1,12 bead81:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=565,566,567,568the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead82:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=561,562,563,564the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead83:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=572,573,574,576,580,581the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead84:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=582,583,584,586,590,591the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead85:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=592,593,594,605,606the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead86:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=596,599,602,603,604the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead87:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=607,608,609,621,622the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead88:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=611,613,617the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead89:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=623,624,625,640,641the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead90:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=627,630,632,636the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead91:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=642,643,644,662,663the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead92:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=646,649,652the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead93:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=655,658,659,660,661the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead94:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=664,665,666,678,679the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead95:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=668,670,674the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead96:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=680,681,682,695,696the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead97:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=684,687,690,691,692the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead98:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=697,698,699,717,718the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead99:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=701,704,707the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead100:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=710,713,714,715,716the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead101:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=719,720,721,741,742the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead102:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=723,726,729the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead103:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=732,733,734,735,738the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead104:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=743,744,745,765,766the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead105:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=747,750,753the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead106:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=756,757,758,759,762the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead107:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=767,768,769,784,785the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead108:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=771,773,777,780the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead109:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=786,787,788,805,806the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead110:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=790,793,794,795the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead111:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=801,802,803,804the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead112:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=796,797,798,799,800the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,16,1 bead113:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=807,808,809,817,818the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead114:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=811,814,815,816the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead115:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=819,820,821,836,837the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead116:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=823,825,829,832the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead117:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=838,839,840,850,851the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead118:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=842,844,848,849the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead119:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=852,853,854,864,865the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead120:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=856,859,860,861the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead121:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=866,867,868,880,881the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead122:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=870,872,876the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead123:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=882,883,884,899,900the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead124:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=886,889,891,895the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead125:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=901,902,903,914,915the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead126:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=905,908,911,912,913the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead127:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=916,917,918,921,922the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead128:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=923,924,925,940,941the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead129:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=927,929,933,936the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead130:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=942,943,944,957,958the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead131:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=946,949,952,953,954the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead132:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=959,960,961,976,977the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead133:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=963,966,968,972the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead134:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=978,979,980,995,996the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead135:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=982,984,988,991the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead136:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=997,998,999,1001,1005,1006the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead137:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1007,1008,1009,1027,1028the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead138:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1011,1014,1017the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead139:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1020,1023,1024,1025,1026the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead140:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1029,1030,1031,1049,1050the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead141:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1033,1036,1039the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead142:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1042,1045,1046,1047,1048the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead143:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1051,1052,1053,1060,1061the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead144:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1055,1058,1059the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead145:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1062,1063,1064,1082,1083the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead146:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1066,1069,1072the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead147:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1075,1078,1079,1080,1081the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead148:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1084,1085,1086,1096,1097the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead149:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1088,1091,1092,1093the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead150:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1098,1099,1100,1113,1114the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead151:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1102,1105the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead152:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1109,1110,1111,1112the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead153:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1106,1107,1108the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead154:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1115,1116,1117,1132,1133the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead155:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1119,1121,1125,1128the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead156:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1134,1135,1136,1149,1150the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead157:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1138,1141,1144,1145,1146the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead158:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1151,1152,1153,1173,1174the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead159:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1155,1158,1172the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead160:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1159,1160,1161,1162,1163the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,14,1,12 bead161:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1168,1169,1170,1171the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead162:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1164,1165,1166,1167the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead163:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1175,1176,1177,1192,1193the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead164:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1179,1182,1184,1188the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead165:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1194,1195,1196,1199,1200the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead166:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1201,1202,1203,1210,1211the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead167:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1205,1208,1209the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead168:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1212,1213,1214,1227,1228the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead169:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1216,1219the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead170:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1223,1224,1225,1226the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead171:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1220,1221,1222the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead172:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1229,1230,1231,1241,1242the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead173:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1233,1235,1239,1240the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead174:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1243,1244,1245,1255,1256the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead175:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1247,1249,1253,1254the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead176:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1257,1258,1259,1271,1272the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead177:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1261,1263,1267the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead178:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1273,1274,1275,1278,1279the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead179:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1280,1281,1282,1294,1295the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead180:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1284,1286,1290the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead181:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1296,1297,1298,1301,1302the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead182:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1303,1304,1305,1308,1309the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead183:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1310,1311,1312,1332,1333the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead184:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1314,1317,1320the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead185:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1323,1324,1325,1326,1329the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead186:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1334,1335,1336,1351,1352the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead187:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1338,1341,1343,1347the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead188:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1353,1354,1355,1366,1367the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead189:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1357,1360,1363,1364,1365the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead190:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1368,1369,1370,1373,1374the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead191:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1375,1376,1377,1392,1393the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead192:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1379,1382,1384,1388the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead193:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1394,1395,1396,1406,1407the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead194:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1398,1400,1404,1405the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead195:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1408,1409,1410,1423,1424the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead196:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1412,1415,1418,1419,1420the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead197:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1425,1426,1427,1435,1436the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead198:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1429,1432,1433,1434the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead199:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1437,1438,1439,1454,1455the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead200:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1441,1444,1446,1450the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead201:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1456,1457,1458,1478,1479the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead202:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1460,1463,1466the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead203:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1469,1470,1471,1472,1475the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead204:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1480,1481,1482,1495,1496the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead205:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1484,1487,1490,1491,1492the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead206:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1497,1498,1499,1514,1515the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead207:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1501,1504,1506,1510the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead208:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1516,1517,1518,1531,1532the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead209:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1520,1523,1526,1527,1528the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead210:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1533,1534,1535,1546,1547the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead211:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1537,1540,1543,1544,1545the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead212:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1548,1549,1550,1557,1558the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead213:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1552,1555,1556the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead214:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1559,1560,1561,1572,1573the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead215:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1563,1566,1569,1570,1571the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead216:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1574,1575,1576,1589,1590the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead217:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1578,1581,1584,1585,1586the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead218:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1591,1592,1593,1606,1607the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead219:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1595,1598,1601,1602,1603the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead220:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1608,1609,1610,1625,1626the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead221:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1612,1615,1617,1621the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead222:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1627,1628,1629,1637,1638the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead223:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1631,1634,1635,1636the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead224:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1639,1640,1641,1654,1655the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead225:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1643,1646the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead226:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1650,1651,1652,1653the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead227:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1647,1648,1649the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead228:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1656,1657,1658,1673,1674the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead229:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1660,1663,1665,1669the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead230:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1675,1676,1677,1690,1691the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead231:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1679,1682,1685,1686the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead232:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1692,1693,1694,1704,1705the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead233:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1696,1699,1700,1701the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead234:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1706,1707,1708,1723,1724the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead235:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1710,1712,1716,1719the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead236:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1725,1726,1727,1734,1735the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead237:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1729,1732the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,32 bead238:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1736,1737,1738,1748,1749the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead239:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1740,1742,1746,1747the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead240:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1750,1751,1752,1762,1763the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead241:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1754,1756,1760,1761the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead242:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1764,1765,1766,1779,1780the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead243:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1768,1771,1774,1775,1776the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead244:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1781,1782,1783,1798,1799the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead245:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1785,1788,1790,1794the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead246:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1800,1801,1802,1822,1823the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead247:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1804,1807,1810the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead248:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1813,1814,1815,1816,1819the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead249:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1824,1825,1826,1841,1842the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead250:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1828,1831,1833,1837the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead251:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1843,1844,1845,1860,1861the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead252:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1847,1850,1852,1856the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead253:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1862,1863,1864,1871,1872the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead254:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1866,1869,1870the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead255:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1873,1874,1875,1886,1887the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead256:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1877,1880,1883,1884,1885the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead257:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1888,1889,1890,1898,1899the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead258:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1892,1895,1896,1897the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead259:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1900,1901,1902,1912,1913the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead260:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1904,1906,1910,1911the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead261:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1914,1915,1916,1924,1925the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead262:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1918,1921,1922,1923the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead263:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1926,1927,1928,1935,1936the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead264:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1930,1933,1934the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead265:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1937,1938,1939,1952,1953the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead266:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1941,1944,1947,1948,1949the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead267:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1954,1955,1956,1976,1977the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead268:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1958,1961,1964the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead269:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1967,1968,1969,1970,1973the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead270:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1978,1979,1980,1995,1996the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead271:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1982,1985,1987,1991the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead272:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=1997,1998,1999,2001,2005,2006the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead273:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2007,2008,2009,2026,2027the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead274:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2011,2014,2015,2016the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead275:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2022,2023,2024,2025the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead276:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2017,2018,2019,2020,2021the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,16,1 bead277:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2028,2029,2030,2042,2043the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead278:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2032,2034,2038the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead279:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2044,2045,2046,2056,2057the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead280:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2048,2050,2054,2055the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead281:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2058,2059,2060,2067,2068the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead282:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2062,2065the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,32 bead283:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2069,2070,2071,2084,2085the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead284:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2073,2076,2079,2080,2081the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead285:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2086,2087,2088,2096,2097the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead286:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2090,2093,2094,2095the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead287:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2098,2099,2100,2115,2116the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead288:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2102,2105,2107,2111the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead289:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2117,2118,2119,2139,2140the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead290:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2121,2124,2127the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead291:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2130,2131,2132,2133,2136the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead292:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2141,2142,2143,2150,2151the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead293:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2145,2148,2149the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead294:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2152,2153,2154,2169,2170the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead295:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2156,2158,2162,2165the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead296:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2171,2172,2173,2175,2179,2180the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead297:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2181,2182,2183,2191,2192the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead298:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2185,2188,2189,2190the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead299:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2193,2203,2205,2206the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead300:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2194,2197,2200the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead301:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2207,2208,2209,2211,2215,2216the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead302:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2217,2218,2219,2230,2231the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead303:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2221,2224,2227,2228,2229the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead304:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2232,2233,2234,2247,2248the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead305:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2236,2239,2242,2243,2244the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead306:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2249,2250,2251,2264,2265the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead307:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2253,2256,2259,2260the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead308:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2266,2267,2268,2280,2281the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead309:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2270,2272,2276the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead310:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2282,2283,2284,2297,2298the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead311:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2286,2289,2292,2293the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead312:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2299,2300,2301,2313,2314the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead313:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2303,2305,2309the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead314:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2315,2316,2317,2332,2333the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead315:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2319,2321,2325,2328the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead316:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2334,2335,2336,2354,2355the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead317:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2338,2341,2344the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead318:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2347,2350,2351,2352,2353the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead319:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2356,2357,2358,2360,2364,2365the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead320:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2366,2376,2378,2379the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead321:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2367,2370,2373the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead322:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2380,2390,2392,2393the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead323:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2381,2384,2387the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead324:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2394,2395,2396,2407,2408the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead325:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2398,2401,2404,2405,2406the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead326:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2409,2410,2411,2421,2422the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead327:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2413,2415,2419,2420the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead328:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2423,2424,2425,2438,2439the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead329:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2427,2430,2433,2434,2435the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead330:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2440,2441,2442,2457,2458the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead331:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2444,2447,2449,2453the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead332:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2459,2460,2461,2474,2475the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead333:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2463,2466,2469,2470,2471the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead334:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2476,2477,2478,2480,2484,2485the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead335:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2486,2487,2488,2500,2501the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead336:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2490,2492,2496the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead337:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2502,2503,2504,2512,2513the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead338:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2506,2509,2510,2511the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead339:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2514,2515,2516,2523,2524the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead340:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2518,2521,2522the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead341:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2525,2526,2527,2534,2535the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead342:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2529,2532,2533the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead343:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2536,2537,2538,2549,2550the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead344:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2540,2543,2546,2547,2548the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead345:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2551,2552,2553,2563,2564the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead346:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2555,2558,2559,2560the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead347:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2565,2566,2567,2583,2584the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead348:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2569,2572,2573,2574the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead349:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2579,2580,2581,2582the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead350:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2575,2576,2577,2578the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead351:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2585,2586,2587,2600,2601the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead352:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2589,2592,2595,2596,2597the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead353:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2602,2603,2604,2619,2620the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead354:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2606,2608,2612,2615the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead355:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2621,2622,2623,2630,2631the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead356:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2625,2628,2629the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead357:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2632,2633,2634,2649,2650the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead358:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2636,2639,2641,2645the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead359:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2651,2652,2653,2671,2672the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead360:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2655,2658,2661the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead361:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2664,2667,2668,2669,2670the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead362:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2673,2674,2675,2682,2683the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead363:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2677,2680,2681the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead364:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2684,2685,2686,2704,2705the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead365:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2688,2691,2694the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead366:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2697,2700,2701,2702,2703the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead367:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2706,2707,2708,2721,2722the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead368:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2710,2713,2716,2717,2718the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead369:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2723,2724,2725,2728,2729the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead370:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2730,2740,2742,2743the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead371:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2731,2734,2737the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead372:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2744,2745,2746,2761,2762the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead373:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2748,2750,2754,2757the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead374:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2763,2764,2765,2773,2774the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead375:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2767,2770,2771,2772the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead376:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2775,2776,2777,2789,2790the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead377:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2779,2781,2785the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead378:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2791,2792,2793,2809,2810the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead379:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2795,2798,2799,2800the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead380:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2805,2806,2807,2808the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead381:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2801,2802,2803,2804the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead382:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2811,2812,2813,2828,2829the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead383:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2815,2818,2820,2824the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead384:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2830,2831,2832,2839,2840the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead385:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2834,2837the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,32 bead386:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2841,2851,2853,2854the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead387:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2842,2845,2848the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead388:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2855,2856,2857,2868,2869the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead389:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2859,2862,2865,2866,2867the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead390:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2870,2871,2872,2883,2884,2885the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16,16 bead391:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2874,2877,2880,2881,2882the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead392:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2886,2887,2888,2889,2890,2910,2911the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,1,1,12,12,16 bead393:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2892,2895,2898the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead394:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2901,2902,2903,2904,2907the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead395:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2912,2913,2914,2917,2918the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead396:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2919,2920,2921,2928,2929the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead397:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2923,2926,2927the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead398:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2930,2931,2932,2945,2946the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead399:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2934,2937the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead400:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2941,2942,2943,2944the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead401:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2938,2939,2940the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead402:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2947,2948,2949,2962,2963the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead403:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2951,2954,2957,2958the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead404:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2964,2965,2966,2986,2987the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead405:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2968,2971,2974the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead406:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2977,2978,2979,2980,2983the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead407:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2988,2989,2990,3000,3001the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead408:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=2992,2995,2996,2997the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead409:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3002,3003,3004,3024,3025the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead410:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3006,3009,3012the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead411:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3015,3016,3017,3018,3021the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead412:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3026,3027,3028,3046,3047the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead413:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3030,3033,3036the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead414:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3039,3042,3043,3044,3045the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead415:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3048,3049,3050,3053,3054the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead416:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3055,3056,3057,3068,3069the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead417:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3059,3062,3065,3066,3067the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead418:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3070,3071,3072,3090,3091the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead419:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3074,3077,3080the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead420:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3083,3086,3087,3088,3089the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead421:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3092,3093,3094,3104,3105the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead422:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3096,3099,3100,3101the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead423:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3106,3107,3108,3111,3112the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead424:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3113,3114,3115,3133,3134the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead425:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3117,3120,3123the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead426:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3126,3129,3130,3131,3132the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead427:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3135,3136,3137,3140,3141the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead428:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3142,3143,3144,3159,3160the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead429:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3146,3149,3151,3155the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead430:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3161,3162,3163,3183,3184the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead431:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3165,3168,3171the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead432:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3174,3175,3176,3177,3180the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead433:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3185,3186,3187,3200,3201the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead434:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3189,3192the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead435:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3196,3197,3198,3199the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead436:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3193,3194,3195the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead437:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3202,3203,3204,3220,3221the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead438:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3206,3209,3210,3211the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead439:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3216,3217,3218,3219the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead440:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3212,3213,3214,3215the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead441:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3222,3223,3224,3231,3232the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead442:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3226,3229,3230the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead443:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3233,3234,3235,3248,3249the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead444:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3237,3240,3243,3244the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead445:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3250,3251,3252,3270,3271the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead446:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3254,3257,3260the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead447:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3263,3266,3267,3268,3269the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead448:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3272,3273,3274,3286,3287the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead449:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3276,3278,3282the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead450:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3288,3289,3290,3297,3298the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead451:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3292,3295the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,32 bead452:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3299,3300,3301,3312,3313the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead453:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3303,3306,3309,3310,3311the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead454:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3314,3315,3316,3334,3335the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead455:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3318,3321,3324the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead456:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3327,3330,3331,3332,3333the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead457:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3336,3337,3338,3350,3351the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead458:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3340,3342,3346the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead459:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3352,3353,3354,3367,3368the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead460:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3356,3359,3362,3363,3364the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead461:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3369,3370,3371,3391,3392the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead462:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3373,3376,3379the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead463:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3382,3383,3384,3385,3388the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead464:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3393,3394,3395,3413,3414the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead465:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3397,3400,3403the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead466:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3406,3409,3410,3411,3412the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead467:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3415,3416,3417,3420,3421the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead468:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3422,3423,3424,3434,3435the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead469:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3426,3428,3432,3433the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead470:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3436,3437,3438,3448,3449the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead471:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3440,3442,3446,3447the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead472:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3450,3451,3452,3459,3460the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead473:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3454,3457,3458the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead474:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3461,3462,3463,3480,3481the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead475:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3465,3468,3469,3470the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead476:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3476,3477,3478,3479the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead477:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3471,3472,3473,3474,3475the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,16,1 bead478:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3482,3483,3484,3494,3495the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead479:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3486,3489,3490,3491the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead480:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3496,3497,3498,3509,3510the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead481:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3500,3503,3506,3507,3508the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead482:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3511,3512,3513,3525,3526the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead483:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3515,3517,3521the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead484:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3527,3528,3529,3531,3535,3536the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead485:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3537,3538,3539,3547,3548the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead486:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3541,3544,3545,3546the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead487:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3549,3550,3551,3562,3563the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead488:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3553,3556,3559,3560,3561the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead489:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3564,3565,3566,3581,3582the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead490:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3568,3571,3573,3577the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead491:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3583,3584,3585,3597,3598the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead492:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3587,3589,3593the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead493:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3599,3600,3601,3603,3607,3608the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead494:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3609,3610,3611,3622,3623the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead495:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3613,3616,3619,3620,3621the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead496:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3624,3625,3626,3642,3643the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead497:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3628,3631,3632,3633the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead498:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3638,3639,3640,3641the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead499:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3634,3635,3636,3637the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead500:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3644,3645,3646,3653,3654the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead501:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3648,3651,3652the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead502:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3655,3656,3657,3659,3663,3664the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead503:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3665,3666,3667,3669,3673,3674the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead504:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3675,3676,3677,3685,3686the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead505:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3679,3682,3683,3684the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead506:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3687,3688,3689,3699,3700the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead507:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3691,3694,3695,3696the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead508:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3701,3702,3703,3716,3717the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead509:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3705,3708the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead510:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3712,3713,3714,3715the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead511:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3709,3710,3711the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead512:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3718,3719,3720,3735,3736the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead513:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3722,3724,3728,3731the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead514:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3737,3738,3739,3754,3755the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead515:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3741,3744,3746,3750the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead516:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3756,3766,3768,3769the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead517:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3757,3760,3763the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead518:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3770,3771,3772,3782,3783the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead519:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3774,3777,3778,3779the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead520:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3784,3785,3786,3797,3798the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead521:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3788,3791,3794,3795,3796the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead522:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3799,3800,3801,3808,3809the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead523:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3803,3806,3807the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead524:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3810,3811,3812,3814,3818,3819the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead525:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3820,3821,3822,3839,3840the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead526:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3824,3827,3828,3829the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead527:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3835,3836,3837,3838the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead528:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3830,3831,3832,3833,3834the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,16,1 bead529:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3841,3842,3843,3851,3852the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead530:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3845,3848,3849,3850the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead531:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3853,3854,3855,3868,3869the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead532:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3857,3860,3863,3864,3865the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead533:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3870,3871,3872,3890,3891the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead534:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3874,3877,3880the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead535:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3883,3886,3887,3888,3889the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead536:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3892,3893,3894,3904,3905the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead537:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3896,3899,3900,3901the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead538:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3906,3907,3908,3923,3924the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead539:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3910,3912,3916,3919the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead540:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3925,3926,3927,3947,3948the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead541:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3929,3932,3935the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead542:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3938,3939,3940,3941,3944the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead543:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3949,3950,3951,3971,3972the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead544:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3953,3956,3959the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead545:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3962,3963,3964,3965,3968the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead546:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3973,3974,3975,3995,3996the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead547:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3977,3980,3983the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead548:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3986,3987,3988,3989,3992the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead549:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=3997,3998,3999,4011,4012the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead550:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4001,4003,4007the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead551:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4013,4014,4015,4032,4033the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead552:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4017,4020,4021,4022the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead553:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4028,4029,4030,4031the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead554:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4023,4024,4025,4026,4027the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,16,1 bead555:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4034,4035,4036,4044,4045the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead556:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4038,4041,4042,4043the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead557:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4046,4047,4048,4050,4054,4055the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead558:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4056,4057,4058,4073,4074the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead559:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4060,4063,4065,4069the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead560:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4075,4076,4077,4087,4088the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead561:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4079,4082,4083,4084the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead562:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4089,4090,4091,4103,4104the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead563:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4093,4095,4099the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead564:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4105,4106,4107,4122,4123the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead565:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4109,4112,4114,4118the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead566:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4124,4125,4126,4139,4140the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead567:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4128,4131,4134,4135the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead568:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4141,4142,4143,4145,4149,4150the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead569:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4151,4152,4153,4166,4167the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead570:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4155,4158,4161,4162the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead571:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4168,4169,4170,4180,4181the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead572:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4172,4175,4176,4177the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead573:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4182,4183,4184,4199,4200the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead574:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4186,4188,4192,4195the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead575:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4201,4202,4203,4218,4219the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead576:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4205,4207,4211,4214the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead577:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4220,4221,4222,4229,4230the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead578:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4224,4227,4228the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead579:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4231,4232,4233,4251,4252the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead580:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4235,4238,4241the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead581:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4244,4247,4248,4249,4250the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead582:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4253,4254,4255,4266,4267the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead583:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4257,4260,4263,4264,4265the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead584:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4268,4269,4270,4288,4289the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead585:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4272,4275,4278the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead586:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4281,4284,4285,4286,4287the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead587:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4290,4291,4292,4310,4311the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead588:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4294,4297,4300the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead589:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4303,4306,4307,4308,4309the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead590:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4312,4313,4314,4325,4326the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead591:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4316,4319,4322,4323,4324the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead592:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4327,4328,4329,4344,4345the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead593:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4331,4333,4337,4340the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead594:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4346,4347,4348,4366,4367the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead595:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4350,4353,4356the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead596:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4359,4362,4363,4364,4365the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead597:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4368,4369,4370,4390,4391the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead598:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4372,4375,4389the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead599:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4376,4377,4378,4379,4380the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,14,1,12 bead600:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4385,4386,4387,4388the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead601:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4381,4382,4383,4384the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead602:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4392,4393,4394,4409,4410the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead603:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4396,4398,4402,4405the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead604:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4411,4412,4413,4416,4417the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead605:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4418,4419,4420,4435,4436the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead606:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4422,4425,4427,4431the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead607:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4437,4447,4449,4450the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead608:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4438,4441,4444the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead609:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4451,4452,4453,4463,4464the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead610:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4455,4457,4461,4462the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead611:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4465,4466,4467,4477,4478the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead612:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4469,4472,4473,4474the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead613:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4479,4480,4481,4488,4489the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead614:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4483,4486,4487the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead615:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4490,4491,4492,4494,4498,4499the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead616:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4500,4501,4502,4515,4516the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead617:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4504,4507,4510,4511,4512the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead618:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4517,4518,4519,4530,4531the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead619:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4521,4524,4527,4528,4529the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead620:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4532,4533,4534,4541,4542the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead621:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4536,4539the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,32 bead622:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4543,4544,4545,4558,4559the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead623:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4547,4550,4553,4554,4555the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead624:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4560,4561,4562,4572,4573the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead625:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4564,4567,4568,4569the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead626:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4574,4575,4576,4591,4592the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead627:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4578,4581,4583,4587the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead628:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4593,4594,4595,4606,4607the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead629:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4597,4600,4603,4604,4605the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead630:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4608,4609,4610,4622,4623the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead631:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4612,4614,4618the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead632:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4624,4625,4626,4637,4638the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead633:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4628,4631,4634,4635,4636the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead634:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4639,4640,4641,4661,4662the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead635:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4643,4646,4649the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead636:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4652,4653,4654,4655,4658the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead637:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4663,4664,4665,4678,4679the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead638:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4667,4670,4673,4674,4675the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead639:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4680,4681,4682,4702,4703the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead640:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4684,4687,4690the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead641:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4693,4694,4695,4696,4699the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead642:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4704,4705,4706,4726,4727the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead643:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4708,4711,4714the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead644:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4717,4718,4719,4720,4723the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead645:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4728,4729,4730,4745,4746the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead646:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4732,4735,4737,4741the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead647:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4747,4748,4749,4760,4761the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead648:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4751,4754,4757,4758,4759the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead649:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4762,4763,4764,4784,4785the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead650:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4766,4769,4772the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead651:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4775,4776,4777,4778,4781the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead652:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4786,4787,4788,4803,4804the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead653:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4790,4792,4796,4799the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead654:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4805,4806,4807,4825,4826the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead655:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4809,4812,4815the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead656:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4818,4821,4822,4823,4824the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead657:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4827,4828,4829,4842,4843the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead658:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4831,4834,4837,4838,4839the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead659:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4844,4845,4846,4864,4865the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead660:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4848,4851,4854the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead661:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4857,4860,4861,4862,4863the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead662:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4866,4867,4868,4881,4882the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead663:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4870,4873,4876,4877,4878the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead664:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4883,4884,4885,4892,4893the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead665:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4887,4890,4891the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead666:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4894,4895,4896,4909,4910the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead667:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4898,4901,4904,4905,4906the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead668:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4911,4912,4913,4928,4929the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead669:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4915,4918,4920,4924the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead670:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4930,4931,4932,4945,4946the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead671:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4934,4937,4940,4941,4942the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead672:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4947,4948,4949,4960,4961the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead673:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4951,4954,4957,4958,4959the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead674:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4962,4963,4964,4979,4980the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead675:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4966,4969,4971,4975the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead676:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4981,4982,4983,4998,4999the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead677:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=4985,4987,4991,4994the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead678:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5000,5001,5002,5017,5018the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead679:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5004,5007,5009,5013the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead680:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5019,5020,5021,5034,5035the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead681:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5023,5026,5029,5030,5031the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead682:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5036,5037,5038,5051,5052the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead683:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5040,5043,5046,5047,5048the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead684:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5053,5054,5055,5070,5071the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead685:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5057,5059,5063,5066the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead686:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5072,5073,5074,5076,5080,5081the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead687:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5082,5083,5084,5100,5101the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead688:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5086,5089,5090,5091the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead689:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5096,5097,5098,5099the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead690:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5092,5093,5094,5095the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead691:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5102,5103,5104,5122,5123the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead692:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5106,5109,5112the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead693:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5115,5118,5119,5120,5121the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead694:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5124,5125,5126,5136,5137the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead695:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5128,5131,5132,5133the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead696:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5138,5139,5140,5155,5156the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead697:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5142,5145,5147,5151the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead698:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5157,5158,5159,5171,5172the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead699:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5161,5163,5167the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead700:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5173,5174,5175,5188,5189the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead701:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5177,5180,5183,5184,5185the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead702:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5190,5191,5192,5212,5213the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead703:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5194,5197,5200the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead704:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5203,5204,5205,5206,5209the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead705:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5214,5215,5216,5226,5227the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead706:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5218,5221,5222,5223the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead707:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5228,5229,5230,5250,5251the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead708:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5232,5235,5238the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead709:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5241,5242,5243,5244,5247the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead710:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5252,5253,5254,5267,5268the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead711:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5256,5259the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead712:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5263,5264,5265,5266the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead713:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5260,5261,5262the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead714:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5269,5270,5271,5273,5277,5278the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead715:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5279,5280,5281,5292,5293the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead716:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5283,5286,5289,5290,5291the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead717:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5294,5295,5296,5309,5310the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead718:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5298,5301,5304,5305,5306the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead719:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5311,5312,5313,5326,5327the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead720:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5315,5318,5321,5322,5323the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead721:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5328,5329,5330,5332,5336,5337the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead722:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5338,5339,5340,5347,5348the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead723:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5342,5345,5346the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead724:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5349,5350,5351,5371,5372the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead725:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5353,5356,5359the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead726:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5362,5363,5364,5365,5368the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead727:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5373,5383,5385,5386the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead728:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5374,5377,5380the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead729:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5387,5397,5399,5400the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead730:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5388,5391,5394the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead731:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5401,5411,5413,5414the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead732:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5402,5405,5408the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead733:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5415,5425,5427,5428the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead734:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5416,5419,5422the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead735:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5429,5430,5431,5441,5442the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead736:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5433,5436,5437,5438the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead737:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5443,5444,5445,5452,5453the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead738:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5447,5450,5451the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead739:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5454,5455,5456,5468,5469the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead740:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5458,5460,5464the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead741:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5470,5471,5472,5487,5488the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead742:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5474,5476,5480,5483the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead743:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5489,5490,5491,5504,5505the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead744:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5493,5496the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead745:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5500,5501,5502,5503the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead746:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5497,5498,5499the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead747:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5506,5507,5508,5523,5524the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead748:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5510,5513,5515,5519the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead749:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5525,5535,5537,5538the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead750:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5526,5529,5532the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead751:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5539,5540,5541,5557,5558the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead752:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5543,5546,5547,5548the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead753:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5553,5554,5555,5556the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead754:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5549,5550,5551,5552the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead755:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5559,5560,5561,5576,5577the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead756:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5563,5565,5569,5572the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead757:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5578,5579,5580,5595,5596the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead758:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5582,5584,5588,5591the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead759:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5597,5598,5599,5611,5612the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead760:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5601,5603,5607the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead761:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5613,5614,5615,5625,5626the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead762:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5617,5620,5621,5622the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead763:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5627,5628,5629,5639,5640the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead764:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5631,5633,5637,5638the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead765:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5641,5642,5643,5650,5651the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead766:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5645,5648,5649the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead767:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5652,5653,5654,5672,5673the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead768:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5656,5659,5662the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead769:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5665,5668,5669,5670,5671the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead770:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5674,5675,5676,5694,5695the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead771:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5678,5681,5684the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead772:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5687,5690,5691,5692,5693the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead773:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5696,5697,5698,5708,5709the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead774:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5700,5702,5706,5707the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead775:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5710,5711,5712,5724,5725the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead776:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5714,5716,5720the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead777:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5726,5727,5728,5743,5744the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead778:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5730,5732,5736,5739the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead779:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5745,5746,5747,5755,5756the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead780:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5749,5752,5753,5754the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead781:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5757,5758,5759,5766,5767the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead782:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5761,5764the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,32 bead783:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5768,5769,5770,5777,5778the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead784:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5772,5775,5776the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead785:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5779,5780,5781,5796,5797the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead786:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5783,5785,5789,5792the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead787:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5798,5799,5800,5807,5808the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead788:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5802,5805,5806the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead789:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5809,5810,5811,5821,5822the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead790:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5813,5816,5817,5818the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead791:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5823,5824,5825,5833,5834the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead792:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5827,5830,5831,5832the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead793:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5835,5836,5837,5855,5856the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead794:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5839,5842,5845the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead795:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5848,5851,5852,5853,5854the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead796:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5857,5858,5859,5875,5876the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead797:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5861,5864,5865,5866the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead798:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5871,5872,5873,5874the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead799:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5867,5868,5869,5870the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead800:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5877,5878,5879,5890,5891the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead801:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5881,5884,5887,5888,5889the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead802:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5892,5893,5894,5911,5912the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead803:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5896,5899,5900,5901the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead804:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5907,5908,5909,5910the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead805:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5902,5903,5904,5905,5906the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,16,1 bead806:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5913,5914,5915,5930,5931the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead807:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5917,5920,5922,5926the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead808:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5932,5933,5934,5950,5951the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead809:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5936,5939,5940,5941the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead810:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5946,5947,5948,5949the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead811:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5942,5943,5944,5945the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead812:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5952,5953,5954,5964,5965the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead813:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5956,5959,5960,5961the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead814:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5966,5967,5968,5984,5985the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead815:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5970,5973,5974,5975the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead816:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5980,5981,5982,5983the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead817:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5976,5977,5978,5979the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead818:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5986,5987,5988,5996,5997the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead819:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5990,5993,5994,5995the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead820:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=5998,5999,6000,6010,6011the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead821:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6002,6005,6006,6007the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,14 bead822:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6012,6013,6014,6024,6025the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead823:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6016,6018,6022,6023the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead824:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6026,6027,6028,6044,6045the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead825:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6030,6033,6034,6035the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead826:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6040,6041,6042,6043the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead827:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6036,6037,6038,6039the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead828:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6046,6047,6048,6059,6060the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead829:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6050,6053,6056,6057,6058the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead830:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6061,6062,6063,6078,6079the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead831:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6065,6067,6071,6074the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead832:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6080,6081,6082,6095,6096the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead833:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6084,6087the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12 bead834:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6091,6092,6093,6094the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,1 bead835:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6088,6089,6090the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,1 bead836:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6097,6098,6099,6107,6108the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead837:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6101,6104,6105,6106the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead838:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6109,6110,6111,6119,6120the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead839:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6113,6116,6117,6118the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead840:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6121,6122,6123,6138,6139the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead841:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6125,6127,6131,6134the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead842:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6140,6141,6142,6153,6154the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead843:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6144,6147,6150,6151,6152the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead844:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6155,6156,6157,6169,6170the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead845:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6159,6161,6165the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead846:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6171,6172,6173,6188,6189the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead847:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6175,6178,6180,6184the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead848:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6190,6191,6192,6210,6211the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead849:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6194,6197,6200the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead850:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6203,6206,6207,6208,6209the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead851:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6212,6213,6214,6234,6235the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead852:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6216,6219,6222the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead853:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6225,6226,6227,6228,6231the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead854:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6236,6237,6238,6251,6252the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead855:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6240,6243,6246,6247the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead856:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6253,6254,6255,6258,6259the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead857:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6260,6261,6262,6275,6276the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead858:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6264,6267,6270,6271the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead859:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6277,6278,6279,6281,6285,6286the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead860:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6287,6288,6289,6296,6297the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead861:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6291,6294the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,32 bead862:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6298,6299,6300,6303,6304the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead863:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6305,6306,6307,6322,6323the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead864:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6309,6312,6314,6318the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead865:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6324,6325,6326,6337,6338the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead866:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6328,6331,6334,6335,6336the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead867:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6339,6340,6341,6348,6349the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead868:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6343,6346,6347the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead869:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6350,6351,6352,6355,6356the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead870:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6357,6358,6359,6366,6367the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead871:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6361,6364,6365the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead872:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6368,6369,6370,6377,6378the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead873:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6372,6375the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,32 bead874:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6379,6380,6381,6388,6389the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead875:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6383,6386,6387the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead876:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6390,6391,6392,6394,6398,6399the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead877:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6400,6401,6402,6413,6414the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead878:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6404,6407,6410,6411,6412the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead879:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6415,6416,6417,6425,6426the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead880:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6419,6422,6423,6424the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,16 bead881:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6427,6428,6429,6444,6445the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead882:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6431,6434,6436,6440the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead883:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6446,6447,6448,6466,6467the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead884:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6450,6453,6456the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead885:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6459,6462,6463,6464,6465the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead886:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6468,6469,6470,6483,6484the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead887:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6472,6475,6478,6479the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead888:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6485,6486,6487,6489,6493,6494the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead889:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6495,6496,6497,6517,6518the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead890:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6499,6502,6505the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead891:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6508,6509,6510,6511,6514the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,14,14 bead892:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6519,6520,6521,6528,6529the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead893:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6523,6526,6527the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead894:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6530,6531,6532,6547,6548the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead895:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6534,6537,6539,6543the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead896:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6549,6550,6551,6563,6564the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead897:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6553,6555,6559the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead898:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6565,6575,6577,6578the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead899:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6566,6569,6572the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead900:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6579,6580,6581,6599,6600the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead901:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6583,6586,6589the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead902:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6592,6595,6596,6597,6598the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,1,1,1 bead903:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6601,6602,6603,6605,6609,6610the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead904:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6611,6612,6613,6628,6629the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead905:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6615,6618,6620,6624the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead906:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6630,6631,6632,6643,6644the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead907:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6634,6637,6640,6641,6642the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead908:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6645,6655,6657,6658the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,12,16 bead909:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6646,6649,6652the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead910:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6659,6660,6661,6678,6679the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead911:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6663,6666,6667,6668the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead912:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6674,6675,6676,6677the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead913:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6669,6670,6671,6672,6673the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,16,1 bead914:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6680,6681,6682,6694,6695the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead915:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6684,6686,6690the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead916:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6696,6697,6698,6708,6709the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead917:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6700,6702,6706,6707the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead918:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6710,6711,6712,6723,6724the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead919:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6714,6717,6720,6721,6722the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,16 bead920:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6725,6726,6727,6740,6741the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead921:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6729,6732,6735,6736the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,32,12 bead922:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6742,6743,6744,6746,6750,6751the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead923:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6752,6753,6754,6767,6768the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead924:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6756,6759,6762,6763,6764the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16,14 bead925:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6769,6770,6771,6774,6775the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead926:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6776,6777,6778,6788,6789the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead927:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6780,6782,6786,6787the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead928:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6790,6791,6792,6804,6805the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead929:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6794,6796,6800the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead930:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6806,6807,6808,6811,6812the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead931:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6813,6814,6815,6818,6819the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead932:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6820,6821,6822,6834,6835the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead933:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6824,6826,6830the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead934:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6836,6837,6838,6854,6855the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead935:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6840,6843,6844,6845the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,1 bead936:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6850,6851,6852,6853the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead937:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6846,6847,6848,6849the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,1,12,1 bead938:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6856,6857,6858,6873,6874the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead939:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6860,6862,6866,6869the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,12 bead940:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6875,6876,6877,6887,6888the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead941:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6879,6881,6885,6886the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead942:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6889,6890,6891,6901,6902the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead943:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6893,6895,6899,6900the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead944:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6903,6904,6905,6907,6911,6912the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,12,16 bead945:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6913,6914,6915,6918,6919the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead946:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6920,6921,6922,6929,6930the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16 bead947:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6924,6927,6928the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,1 bead948:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6931,6932,6933,6943,6944,6945the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,1,12,12,16,16 bead949:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6935,6937,6941,6942the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16,1 bead950:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6948,6951,6953the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead951:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6954,6970,6972the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead952:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6956,6957the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead953:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6966,6968,6969the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead954:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6959,6960,6964,6965the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16 bead955:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6976,6977,6978,6979,6975the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead956:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6980,6983,6985the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead957:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6986,7002,7004the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead958:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6988,6989the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead959:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6998,7000,7001the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead960:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=6991,6992,6996,6997the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16 bead961:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7008,7009,7010,7011,7007the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead962:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7012,7015,7017the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead963:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7018,7034,7036the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead964:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7020,7021the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead965:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7030,7032,7033the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead966:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7023,7024,7028,7029the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16 bead967:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7040,7041,7042,7043,7039the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead968:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7044,7047,7049the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead969:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7050,7066,7068the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead970:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7052,7065the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead971:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7062,7064the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14 bead972:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7057,7058,7061the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead973:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7053,7055,7056the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead974:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7072,7073,7074,7075,7071the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead975:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7076,7079,7081the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead976:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7082,7096,7098the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead977:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7084,7085the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead978:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7093,7094,7095the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead979:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7087,7089,7090the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,14 bead980:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7102,7103,7104,7105,7101the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead981:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7106,7109,7111the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead982:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7112,7129,7131the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead983:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7114,7128the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead984:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7123,7124,7127the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead985:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7119,7120,7121the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,14 bead986:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7115,7117,7118the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead987:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7135,7136,7137,7138,7134the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead988:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7139,7142,7144the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead989:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7145,7159,7161the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead990:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7147,7148the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead991:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7156,7157,7158the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead992:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7150,7152,7153the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,14 bead993:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7165,7166,7167,7168,7164the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead994:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7169,7172,7174the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead995:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7175,7192,7194the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead996:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7177,7191the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead997:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7186,7187,7190the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead998:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7182,7183,7184the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,14 bead999:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7178,7180,7181the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1000:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7198,7199,7200,7201,7197the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1001:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7202,7205,7207the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1002:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7208,7222,7224the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1003:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7210,7211the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1004:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7219,7220,7221the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1005:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7213,7215,7216the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,14 bead1006:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7228,7229,7230,7231,7227the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1007:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7232,7235,7237the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1008:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7238,7252,7254the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1009:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7240,7241the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1010:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7249,7250,7251the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1011:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7243,7245,7246the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,14 bead1012:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7258,7259,7260,7261,7257the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1013:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7262,7265,7267the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1014:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7268,7284,7286the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1015:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7270,7283the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1016:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7280,7282the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14 bead1017:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7275,7276,7279the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1018:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7271,7273,7274the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1019:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7290,7291,7292,7293,7289the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1020:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7294,7297,7299the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1021:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7300,7316,7318the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1022:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7302,7315the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1023:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7312,7314the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14 bead1024:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7307,7308,7311the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1025:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7303,7305,7306the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1026:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7322,7323,7324,7325,7321the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1027:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7326,7329,7331the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1028:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7332,7348,7350the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1029:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7334,7347the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1030:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7344,7346the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14 bead1031:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7339,7340,7343the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1032:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7335,7337,7338the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1033:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7354,7355,7356,7357,7353the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1034:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7358,7361,7363the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1035:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7364,7380,7382the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1036:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7366,7367the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1037:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7376,7378,7379the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1038:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7369,7370,7374,7375the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16 bead1039:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7386,7387,7388,7389,7385the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1040:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7390,7393,7395the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1041:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7396,7410,7412the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1042:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7398,7399the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1043:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7407,7408,7409the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1044:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7401,7403,7404the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,14 bead1045:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7419,7422,7424the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1046:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7425,7442,7444the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1047:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7427,7441the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1048:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7436,7437,7440the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1049:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7432,7433,7434the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,14 bead1050:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7428,7430,7431the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1051:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7448,7449,7450,7451,7447the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1052:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7452,7455,7457the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1053:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7458,7474,7476the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1054:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7460,7473the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1055:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7470,7472the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14 bead1056:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7465,7466,7469the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1057:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7461,7463,7464the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1058:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7480,7481,7482,7483,7479the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1059:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7484,7487,7489the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1060:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7490,7506,7508the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1061:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7492,7493the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1062:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7502,7504,7505the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1063:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7495,7496,7500,7501the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16 bead1064:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7512,7513,7514,7515,7511the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1065:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7516,7519,7521the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1066:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7522,7538,7540the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1067:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7524,7525the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1068:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7534,7536,7537the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1069:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7527,7528,7532,7533the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16 bead1070:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7544,7545,7546,7547,7543the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1071:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7548,7551,7553the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1072:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7554,7570,7572the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1073:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7556,7557the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1074:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7566,7568,7569the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1075:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7559,7560,7564,7565the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16 bead1076:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7576,7577,7578,7579,7575the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1077:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7580,7583,7585the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1078:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7586,7603,7605the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1079:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7588,7602the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1080:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7597,7598,7601the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1081:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7593,7594,7595the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,14 bead1082:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7589,7591,7592the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1083:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7609,7610,7611,7612,7608the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1084:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7613,7616,7618the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1085:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7619,7636,7638the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1086:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7621,7635the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1087:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7630,7631,7634the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1088:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7626,7627,7628the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,14 bead1089:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7622,7624,7625the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1090:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7642,7643,7644,7645,7641the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1091:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7646,7649,7651the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1092:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7652,7666,7668the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1093:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7654,7655the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1094:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7663,7664,7665the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1095:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7657,7659,7660the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,14 bead1096:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7672,7673,7674,7675,7671the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1097:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7676,7679,7681the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1098:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7682,7699,7701the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1099:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7684,7698the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1100:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7693,7694,7697the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1101:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7689,7690,7691the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,14 bead1102:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7685,7687,7688the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1103:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7705,7706,7707,7708,7704the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1104:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7709,7712,7714the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1105:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7715,7729,7731the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1106:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7717,7718the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1107:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7726,7727,7728the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1108:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7720,7722,7723the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,14 bead1109:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7735,7736,7737,7738,7734the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1110:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7739,7742,7744the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1111:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7745,7762,7764the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1112:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7747,7761the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1113:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7756,7757,7760the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1114:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7752,7753,7754the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,16,14 bead1115:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7748,7750,7751the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1116:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7768,7769,7770,7771,7767the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1117:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7772,7775,7777the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1118:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7778,7794,7796the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1119:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7780,7781the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1120:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7790,7792,7793the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12,16 bead1121:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7783,7784,7788,7789the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12,16 bead1122:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7800,7801,7802,7803,7799the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1123:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7804,7807,7809the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1124:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7810,7826,7828the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1125:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7812,7825the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1126:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7822,7824the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14 bead1127:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7817,7818,7821the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1128:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7813,7815,7816the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1129:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7832,7833,7834,7835,7831the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1130:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7836,7839,7841the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1131:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7842,7858,7860the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1132:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7844,7857the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1133:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7854,7856the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14 bead1134:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7849,7850,7853the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1135:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7845,7847,7848the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12 bead1136:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7864,7865,7866,7867,7863the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=31,16,16,16,16 bead1137:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7868,7871,7873the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,16 bead1138:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7874,7890,7892the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,12,12 bead1139:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7876,7889the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=14,12 bead1140:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7886,7888the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14 bead1141:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7881,7882,7885the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,14 bead1142:what weights should be used when calculating the centerCENTERCalculate the center for a group of atoms, with arbitrary weights. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=7877,7879,7880the group of atoms that you are calculating the Gyration Tensor forWEIGHTS=12,14,12what weights should be used when calculating the center
martini:GROUPDefine a group of atoms so that a particular list of atoms can be referenced with a single label in definitions of CVs or virtual atoms. More detailsATOMS=bead1,bead2,bead3,bead4,bead5,bead6,bead7,bead8,bead9,bead10,bead11,bead12,bead13,bead14,bead15,bead16,bead17,bead18,bead19,bead20,bead21,bead22,bead23,bead24,bead25,bead26,bead27,bead28,bead29,bead30,bead31,bead32,bead33,bead34,bead35,bead36,bead37,bead38,bead39,bead40,bead41,bead42,bead43,bead44,bead45,bead46,bead47,bead48,bead49,bead50,bead51,bead52,bead53,bead54,bead55,bead56,bead57,bead58,bead59,bead60,bead61,bead62,bead63,bead64,bead65,bead66,bead67,bead68,bead69,bead70,bead71,bead72,bead73,bead74,bead75,bead76,bead77,bead78,bead79,bead80,bead81,bead82,bead83,bead84,bead85,bead86,bead87,bead88,bead89,bead90,bead91,bead92,bead93,bead94,bead95,bead96,bead97,bead98,bead99,bead100,bead101,bead102,bead103,bead104,bead105,bead106,bead107,bead108,bead109,bead110,bead111,bead112,bead113,bead114,bead115,bead116,bead117,bead118,bead119,bead120,bead121,bead122,bead123,bead124,bead125,bead126,bead127,bead128,bead129,bead130,bead131,bead132,bead133,bead134,bead135,bead136,bead137,bead138,bead139,bead140,bead141,bead142,bead143,bead144,bead145,bead146,bead147,bead148,bead149,bead150,bead151,bead152,bead153,bead154,bead155,bead156,bead157,bead158,bead159,bead160,bead161,bead162,bead163,bead164,bead165,bead166,bead167,bead168,bead169,bead170,bead171,bead172,bead173,bead174,bead175,bead176,bead177,bead178,bead179,bead180,bead181,bead182,bead183,bead184,bead185,bead186,bead187,bead188,bead189,bead190,bead191,bead192,bead193,bead194,bead195,bead196,bead197,bead198,bead199,bead200,bead201,bead202,bead203,bead204,bead205,bead206,bead207,bead208,bead209,bead210,bead211,bead212,bead213,bead214,bead215,bead216,bead217,bead218,bead219,bead220,bead221,bead222,bead223,bead224,bead225,bead226,bead227,bead228,bead229,bead230,bead231,bead232,bead233,bead234,bead235,bead236,bead237,bead238,bead239,bead240,bead241,bead242,bead243,bead244,bead245,bead246,bead247,bead248,bead249,bead250,bead251,bead252,bead253,bead254,bead255,bead256,bead257,bead258,bead259,bead260,bead261,bead262,bead263,bead264,bead265,bead266,bead267,bead268,bead269,bead270,bead271,bead272,bead273,bead274,bead275,bead276,bead277,bead278,bead279,bead280,bead281,bead282,bead283,bead284,bead285,bead286,bead287,bead288,bead289,bead290,bead291,bead292,bead293,bead294,bead295,bead296,bead297,bead298,bead299,bead300,bead301,bead302,bead303,bead304,bead305,bead306,bead307,bead308,bead309,bead310,bead311,bead312,bead313,bead314,bead315,bead316,bead317,bead318,bead319,bead320,bead321,bead322,bead323,bead324,bead325,bead326,bead327,bead328,bead329,bead330,bead331,bead332,bead333,bead334,bead335,bead336,bead337,bead338,bead339,bead340,bead341,bead342,bead343,bead344,bead345,bead346,bead347,bead348,bead349,bead350,bead351,bead352,bead353,bead354,bead355,bead356,bead357,bead358,bead359,bead360,bead361,bead362,bead363,bead364,bead365,bead366,bead367,bead368,bead369,bead370,bead371,bead372,bead373,bead374,bead375,bead376,bead377,bead378,bead379,bead380,bead381,bead382,bead383,bead384,bead385,bead386,bead387,bead388,bead389,bead390,bead391,bead392,bead393,bead394,bead395,bead396,bead397,bead398,bead399,bead400,bead401,bead402,bead403,bead404,bead405,bead406,bead407,bead408,bead409,bead410,bead411,bead412,bead413,bead414,bead415,bead416,bead417,bead418,bead419,bead420,bead421,bead422,bead423,bead424,bead425,bead426,bead427,bead428,bead429,bead430,bead431,bead432,bead433,bead434,bead435,bead436,bead437,bead438,bead439,bead440,bead441,bead442,bead443,bead444,bead445,bead446,bead447,bead448,bead449,bead450,bead451,bead452,bead453,bead454,bead455,bead456,bead457,bead458,bead459,bead460,bead461,bead462,bead463,bead464,bead465,bead466,bead467,bead468,bead469,bead470,bead471,bead472,bead473,bead474,bead475,bead476,bead477,bead478,bead479,bead480,bead481,bead482,bead483,bead484,bead485,bead486,bead487,bead488,bead489,bead490,bead491,bead492,bead493,bead494,bead495,bead496,bead497,bead498,bead499,bead500,bead501,bead502,bead503,bead504,bead505,bead506,bead507,bead508,bead509,bead510,bead511,bead512,bead513,bead514,bead515,bead516,bead517,bead518,bead519,bead520,bead521,bead522,bead523,bead524,bead525,bead526,bead527,bead528,bead529,bead530,bead531,bead532,bead533,bead534,bead535,bead536,bead537,bead538,bead539,bead540,bead541,bead542,bead543,bead544,bead545,bead546,bead547,bead548,bead549,bead550,bead551,bead552,bead553,bead554,bead555,bead556,bead557,bead558,bead559,bead560,bead561,bead562,bead563,bead564,bead565,bead566,bead567,bead568,bead569,bead570,bead571,bead572,bead573,bead574,bead575,bead576,bead577,bead578,bead579,bead580,bead581,bead582,bead583,bead584,bead585,bead586,bead587,bead588,bead589,bead590,bead591,bead592,bead593,bead594,bead595,bead596,bead597,bead598,bead599,bead600,bead601,bead602,bead603,bead604,bead605,bead606,bead607,bead608,bead609,bead610,bead611,bead612,bead613,bead614,bead615,bead616,bead617,bead618,bead619,bead620,bead621,bead622,bead623,bead624,bead625,bead626,bead627,bead628,bead629,bead630,bead631,bead632,bead633,bead634,bead635,bead636,bead637,bead638,bead639,bead640,bead641,bead642,bead643,bead644,bead645,bead646,bead647,bead648,bead649,bead650,bead651,bead652,bead653,bead654,bead655,bead656,bead657,bead658,bead659,bead660,bead661,bead662,bead663,bead664,bead665,bead666,bead667,bead668,bead669,bead670,bead671,bead672,bead673,bead674,bead675,bead676,bead677,bead678,bead679,bead680,bead681,bead682,bead683,bead684,bead685,bead686,bead687,bead688,bead689,bead690,bead691,bead692,bead693,bead694,bead695,bead696,bead697,bead698,bead699,bead700,bead701,bead702,bead703,bead704,bead705,bead706,bead707,bead708,bead709,bead710,bead711,bead712,bead713,bead714,bead715,bead716,bead717,bead718,bead719,bead720,bead721,bead722,bead723,bead724,bead725,bead726,bead727,bead728,bead729,bead730,bead731,bead732,bead733,bead734,bead735,bead736,bead737,bead738,bead739,bead740,bead741,bead742,bead743,bead744,bead745,bead746,bead747,bead748,bead749,bead750,bead751,bead752,bead753,bead754,bead755,bead756,bead757,bead758,bead759,bead760,bead761,bead762,bead763,bead764,bead765,bead766,bead767,bead768,bead769,bead770,bead771,bead772,bead773,bead774,bead775,bead776,bead777,bead778,bead779,bead780,bead781,bead782,bead783,bead784,bead785,bead786,bead787,bead788,bead789,bead790,bead791,bead792,bead793,bead794,bead795,bead796,bead797,bead798,bead799,bead800,bead801,bead802,bead803,bead804,bead805,bead806,bead807,bead808,bead809,bead810,bead811,bead812,bead813,bead814,bead815,bead816,bead817,bead818,bead819,bead820,bead821,bead822,bead823,bead824,bead825,bead826,bead827,bead828,bead829,bead830,bead831,bead832,bead833,bead834,bead835,bead836,bead837,bead838,bead839,bead840,bead841,bead842,bead843,bead844,bead845,bead846,bead847,bead848,bead849,bead850,bead851,bead852,bead853,bead854,bead855,bead856,bead857,bead858,bead859,bead860,bead861,bead862,bead863,bead864,bead865,bead866,bead867,bead868,bead869,bead870,bead871,bead872,bead873,bead874,bead875,bead876,bead877,bead878,bead879,bead880,bead881,bead882,bead883,bead884,bead885,bead886,bead887,bead888,bead889,bead890,bead891,bead892,bead893,bead894,bead895,bead896,bead897,bead898,bead899,bead900,bead901,bead902,bead903,bead904,bead905,bead906,bead907,bead908,bead909,bead910,bead911,bead912,bead913,bead914,bead915,bead916,bead917,bead918,bead919,bead920,bead921,bead922,bead923,bead924,bead925,bead926,bead927,bead928,bead929,bead930,bead931,bead932,bead933,bead934,bead935,bead936,bead937,bead938,bead939,bead940,bead941,bead942,bead943,bead944,bead945,bead946,bead947,bead948,bead949,bead950,bead951,bead952,bead953,bead954,bead955,bead956,bead957,bead958,bead959,bead960,bead961,bead962,bead963,bead964,bead965,bead966,bead967,bead968,bead969,bead970,bead971,bead972,bead973,bead974,bead975,bead976,bead977,bead978,bead979,bead980,bead981,bead982,bead983,bead984,bead985,bead986,bead987,bead988,bead989,bead990,bead991,bead992,bead993,bead994,bead995,bead996,bead997,bead998,bead999,bead1000,bead1001,bead1002,bead1003,bead1004,bead1005,bead1006,bead1007,bead1008,bead1009,bead1010,bead1011,bead1012,bead1013,bead1014,bead1015,bead1016,bead1017,bead1018,bead1019,bead1020,bead1021,bead1022,bead1023,bead1024,bead1025,bead1026,bead1027,bead1028,bead1029,bead1030,bead1031,bead1032,bead1033,bead1034,bead1035,bead1036,bead1037,bead1038,bead1039,bead1040,bead1041,bead1042,bead1043,bead1044,bead1045,bead1046,bead1047,bead1048,bead1049,bead1050,bead1051,bead1052,bead1053,bead1054,bead1055,bead1056,bead1057,bead1058,bead1059,bead1060,bead1061,bead1062,bead1063,bead1064,bead1065,bead1066,bead1067,bead1068,bead1069,bead1070,bead1071,bead1072,bead1073,bead1074,bead1075,bead1076,bead1077,bead1078,bead1079,bead1080,bead1081,bead1082,bead1083,bead1084,bead1085,bead1086,bead1087,bead1088,bead1089,bead1090,bead1091,bead1092,bead1093,bead1094,bead1095,bead1096,bead1097,bead1098,bead1099,bead1100,bead1101,bead1102,bead1103,bead1104,bead1105,bead1106,bead1107,bead1108,bead1109,bead1110,bead1111,bead1112,bead1113,bead1114,bead1115,bead1116,bead1117,bead1118,bead1119,bead1120,bead1121,bead1122,bead1123,bead1124,bead1125,bead1126,bead1127,bead1128,bead1129,bead1130,bead1131,bead1132,bead1133,bead1134,bead1135,bead1136,bead1137,bead1138,bead1139,bead1140,bead1141,bead1142 # --- End of included input ---the numerical indexes for the set of atoms in the groupINCLUDEIncludes an external input file, similar to #include in C preprocessor. More details. Show included fileFILE=plumed-restraints.dat # The command: # INCLUDE FILE=plumed-restraints.dat # ensures PLUMED loads the contents of the file called plumed-restraints.dat # The contents of this file are shown below (click the red comment to hide them). # RESTRAIN DNAfile to be included
A466_T437_H1:DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@N6-466,the N6 atom in residue 466. Click here for more information.@O4-437The DISTANCE action with label A466_T437_H1 calculates a scalar quantityA466_T437_H2:the O4 atom in residue 437. Click here for more information.DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@N1-466,the N1 atom in residue 466. Click here for more information.@N3-437the N3 atom in residue 437. Click here for more information.
The DISTANCE action with label A466_T437_H2 calculates a scalar quantityG452_C451_H1:DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@N2-452,the N2 atom in residue 452. Click here for more information.@O2-451The DISTANCE action with label G452_C451_H1 calculates a scalar quantityG452_C451_H2:the O2 atom in residue 451. Click here for more information.DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@N1-452,the N1 atom in residue 452. Click here for more information.@N3-451The DISTANCE action with label G452_C451_H2 calculates a scalar quantityG452_C451_H3:the N3 atom in residue 451. Click here for more information.DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@O6-452,the O6 atom in residue 452. Click here for more information.@N4-451the N4 atom in residue 451. Click here for more information.
The DISTANCE action with label G452_C451_H3 calculates a scalar quantityRESTRAINTAdds harmonic and/or linear restraints on one or more variables. More detailsARG=A466_T437_H1,A466_T437_H2,G452_C451_H1,G452_C451_H2,G452_C451_H3the arguments on which the bias is actingAT=0.29,0.29,0.29,0.29,0.29the position of the restraintKAPPA=2000.0,2000.0,2000.0,2000.0,2000.0specifies that the restraint is harmonic and what the values of the force constants on each of the variables areLABEL=RESTRAINT_DNAa label for the action so that its output can be referenced in the input to other actions
# RESTRAIN ARGININE HBONDS # see Genes Dev. 1999 Mar 15; 13(6): 666–674 [Reference paper for pdb: 1cf7]. Figure 4. # consider common recognition sequence: C442-C445/G458-G462
R46_DG458:DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@NE-46,the NE atom in residue 46. Click here for more information.@O6-458The DISTANCE action with label R46_DG458 calculates a scalar quantityR47_DG444:the O6 atom in residue 458. Click here for more information.DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@NH2-47,the NH2 atom in residue 47. Click here for more information.@O6-444The DISTANCE action with label R47_DG444 calculates a scalar quantityR250_DG442:the O6 atom in residue 444. Click here for more information.DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@NE-250,the NE atom in residue 250. Click here for more information.@O6-442The DISTANCE action with label R250_DG442 calculates a scalar quantityR251_DG460:the O6 atom in residue 442. Click here for more information.DISTANCECalculate the distance between a pair of atoms. More detailsNOPBCignore the periodic boundary conditions when calculating distancesATOMS=the pair of atom that we are calculating the distance between@NH2-251,the NH2 atom in residue 251. Click here for more information.@O6-460the O6 atom in residue 460. Click here for more information.
The DISTANCE action with label R251_DG460 calculates a scalar quantityRESTRAINTAdds harmonic and/or linear restraints on one or more variables. More detailsARG=R46_DG458,R47_DG444,R250_DG442,R251_DG460the arguments on which the bias is actingAT=0.29,0.29,0.29,0.29the position of the restraintKAPPA=2000.0,2000.0,2000.0,2000.0specifies that the restraint is harmonic and what the values of the force constants on each of the variables areLABEL=RESTRAINT_ARGa label for the action so that its output can be referenced in the input to other actionsPrint quantities to a file. More detailsARG=RESTRAINT_DNA.bias,RESTRAINT_ARG.biasthe input for this action is the scalar output from one or more other actionsSTRIDE=2000the frequency with which the quantities of interest should be outputFILE=RESTRAINTSthe name of the file on which to output these quantitiesPrint quantities to a file. More detailsARG=A466_T437_H1,A466_T437_H2,G452_C451_H1,G452_C451_H2,G452_C451_H3,R46_DG458,R47_DG444,R250_DG442,R251_DG460the input for this action is the scalar output from one or more other actionsSTRIDE=2000the frequency with which the quantities of interest should be outputFILE=HBONDSthe name of the file on which to output these quantities
# --- End of included input ---INCLUDEIncludes an external input file, similar to #include in C preprocessor. More details. Show included fileFILE=plumed-SAXS_12q.dat # The command: # INCLUDE FILE=plumed-SAXS_12q.dat # ensures PLUMED loads the contents of the file called plumed-SAXS_12q.dat # The contents of this file are shown below (click the red comment to hide them).file to be includedSAXS...Calculates SAXS intensity. More detailsLABEL=saxsCGa label for the action so that its output can be referenced in the input to other actionsATOMS=martiniThe atoms to be included in the calculation, eMARTINICalculate SAXS for a Martini modelNOPBC#GPUIgnore the periodic boundary conditions when calculating distancesSCALE_EXPINT=107.069000Scaling value for experimental data normalizationQVALUE1=0.008900Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT1=103.136000Add an experimental value for each q valueQVALUE2=0.026714Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT2=77.162100Add an experimental value for each q valueQVALUE3=0.044528Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT3=46.442600Add an experimental value for each q valueQVALUE4=0.062343Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT4=27.614400Add an experimental value for each q valueQVALUE5=0.080157Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT5=19.054000Add an experimental value for each q valueQVALUE6=0.097971Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT6=12.904200Add an experimental value for each q valueQVALUE7=0.115785Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT7=7.450970Add an experimental value for each q valueQVALUE8=0.133599Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT8=4.302110Add an experimental value for each q valueQVALUE9=0.151413Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT9=2.881410Add an experimental value for each q valueQVALUE10=0.169227Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT10=1.852090Add an experimental value for each q valueQVALUE11=0.187041Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT11=1.200270Add an experimental value for each q valueQVALUE12=0.204855Selected scattering lengths in inverse angstroms are given as QVALUE1, QVALUE2,EXPINT12=1.021820 # METAINFERENCEAdd an experimental value for each q valueDOSCOREactivate metainferenceSIGMA0=2.0initial value of the uncertainty parameterSIGMA_MIN=0.001,0.001,0.001,0.001,0.001,0.001,0.001,0.001,0.001,0.001,0.001,0.001minimum value of the uncertainty parameterSIGMA_MAX=0.769355,4.928531,6.467537,3.017866,1.278125,1.699344,0.613271,0.250122,0.195501,0.129698,0.097217,0.083433maximum value of the uncertainty parameterMC_CHUNKSIZE=1MC chunksizeMC_STEPS=12number of MC stepsNOISETYPE=MGAUSSfunctional form of the noise (GAUSS,MGAUSS,OUTLIERS,MOUTLIERS,GENERIC)SCALEDATASet to TRUE if you want to sample a scaling factor common to all values and replicasSCALE_PRIOR=FLATeither FLAT or GAUSSIANSCALE0=1.00initial value of the scaling factorSCALE_MIN=0.7minimum value of the scaling factorSCALE_MAX=1.3maximum value of the scaling factorDSCALE=0.0002maximum MC move of the scaling factorSIGMA_MEAN0=2starting value for the uncertainty in the mean estimateOPTSIGMAMEAN=SEMSet to NONE/SEM to manually set sigma mean, or to estimate it on the flyAVERAGING=100Stride for calculation of averaged weights and sigma_meanWRITE_STRIDE=1000 ... SAXSwrite the status to a file every N steps, this can be used for restart/continuation
The SAXS action with label saxsCG calculates the following quantities:saxsbias:
Quantity Description saxsCG.score the Metainference score saxsCG.sigma uncertainty parameter saxsCG.sigmaMean uncertainty in the mean estimate saxsCG.neff effective number of replicas saxsCG.acceptSigma MC acceptance for sigma values saxsCG.acceptScale MC acceptance for scale value saxsCG.scale scale parameter saxsCG.q The # SAXS of q BIASVALUETakes the value of one variable and use it as a bias More detailsARG=(saxsCG\.scorethe input for this action is the scalar output from one or more other actionsSTRIDE=6 The BIASVALUE action with label saxsbias calculates the following quantities:the frequency with which the forces due to the bias should be calculatedens:
Quantity Description saxsbias.bias the instantaneous value of the bias potential saxsbias._bias one or multiple instances of this quantity can be referenced elsewhere in the input file ENSEMBLECalculates the replica averaging of a collective variable over multiple replicas. More detailsARG=(saxsCG\.q The ENSEMBLE action with label ens calculates a scalar quantitystatCG:the input for this action is the scalar output from one or more other actionsSTATSCalculates statistical properties of a set of collective variables with respect to a set of reference values. More detailsARG=(ens\.saxsCG\.qthe input for this action is the scalar output from one or more other actionsPARARG=(saxsCG\.expthe input for this action is the scalar output from one or more other actions without derivatives
# PRINT The STATS action with label statCG calculates the following quantities:
Quantity Description statCG.sqdevsum the sum of the squared deviations between arguments and parameters statCG.corr the correlation between arguments and parameters statCG.slope the slope of a linear fit between arguments and parameters statCG.intercept the intercept of a linear fit between arguments and parameters Print quantities to a file. More detailsARG=(saxsCG\.score),(saxsCG\.scale),(saxsCG\.acceptScale),(saxsCG\.acceptSigma),(saxsCG\.sigmathe input for this action is the scalar output from one or more other actionsSTRIDE=500the frequency with which the quantities of interest should be outputFILE=BAYES.SAXSthe name of the file on which to output these quantitiesPrint quantities to a file. More detailsARG=(saxsCG\.qthe input for this action is the scalar output from one or more other actionsFILE=SAXSINTCGthe name of the file on which to output these quantitiesSTRIDE=2500the frequency with which the quantities of interest should be outputPrint quantities to a file. More detailsARG=statCG.*,(ens\.saxsCG\.qthe input for this action is the scalar output from one or more other actionsFILE=ST.SAXSCGthe name of the file on which to output these quantitiesSTRIDE=2500 # --- End of included input ---the frequency with which the quantities of interest should be output