**Project ID:** plumID:19.021

**Source:** ./Trajectories/EDS-flattening-enm/flatten-dihed-mean-target/meant_0.11/gatp-enm-12site_FEStart_eq175ns.range10_init0/gatp-enm-12site_FEStart_eq175ns.range10_init0.25ps.run.20000000.plumed.dat

**Originally used with PLUMED version:** 2.5b

**Stable:** zipped raw stdout - zipped raw stderr - stderr

**Master:** zipped raw stdout - zipped raw stderr - stderr

#cleft_distDISTANCECalculate the distance between a pair of atoms. More detailsATOMS=2,4the pair of atom that we are calculating the distance betweenLABEL=a label for the action so that its output can be referenced in the input to other actionscleft_distTORSIONCalculate a torsional angle. More detailsATOMS=2,1,3,4the four atoms involved in the torsional angleLABEL=a label for the action so that its output can be referenced in the input to other actionsdihedraldcn:COMBINECalculate a polynomial combination of a set of other variables. More detailsARG=the input to this functiondihedralPOWERS=1the powers to which you are raising each of the arguments in your functionCOEFFICIENTS=-1the coefficients of the arguments in your functionPERIODIC=NOif the output of your function is periodic then you should specify the periodicity of the functiondc2:COMBINECalculate a polynomial combination of a set of other variables. More detailsARG=the input to this functiondihedralPOWERS=2the powers to which you are raising each of the arguments in your functionPERIODIC=NOif the output of your function is periodic then you should specify the periodicity of the function

#bias mean and varianceeds:EDSAdd a linear bias on a set of observables. This action has hidden defaults. More detailsARG=the input for this action is the scalar output from one or more other actionsdcnCENTER=0.11The desired centers (equilibrium values) which will be sought during the adaptive linear biasingPERIOD=2500Steps over which to adjust bias for adaptive or rampingOUT_RESTART=gatp-enm-12site_FEStart_eq175ns.range10_init0.25ps.run.20000000.restart.datOutput file for all information needed to continue EDS simulationRANGE=10.0The (starting) maximum increase in coupling constant per PERIOD (in k_B T/[BIAS_SCALE unit]) for each CV biasedINIT=0Starting value for coupling constant

#write every 100 psPrint quantities to a file. More detailsARG=the input for this action is the scalar output from one or more other actionscleft_dist,dcn,eds.dcn_coupling,eds.bias,eds.force2FILE=gatp-enm-12site_FEStart_eq175ns.range10_init0.25ps.run.20000000.colvars.datthe name of the file on which to output these quantitiesSTRIDE=1000the frequency with which the quantities of interest should be output