Project ID: plumID:22.021
Source: IceV-Liquid/4-BiasedCoexistence/COEX_4000.0atm/235.0K/plumed.strict.dat
Originally used with PLUMED version: 2.8
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr

Click on the labels of the actions for more information on what each action computes
tested onv2.9
tested onmaster
# Strict counting of molecules
ENVIRONMENTSIMILARITY
Measure how similar the environment around atoms is to that found in some reference crystal structure. This action is a shortcut and it has hidden defaults. More details
...
SPECIES
this keyword is used for colvars such as coordination number
=1-2016:3
SIGMA
the width to use for the gaussian kernels
=0.0725
CRYSTAL_STRUCTURE
Targeted crystal structure
=CUSTOM
LABEL
a label for the action so that its output can be referenced in the input to other actions
=refcv2
REFERENCE_1
PDB files with relative distances from central atom
=env1.pdb
REFERENCE_2
PDB files with relative distances from central atom
=env2.pdb
REFERENCE_3
PDB files with relative distances from central atom
=env3.pdb
REFERENCE_4
PDB files with relative distances from central atom
=env4.pdb
REFERENCE_5
PDB files with relative distances from central atom
=env5.pdb
REFERENCE_6
PDB files with relative distances from central atom
=env6.pdb
REFERENCE_7
PDB files with relative distances from central atom
=env7.pdb
REFERENCE_8
PDB files with relative distances from central atom
=env8.pdb
REFERENCE_9
PDB files with relative distances from central atom
=env9.pdb
REFERENCE_10
PDB files with relative distances from central atom
=env10.pdb
REFERENCE_11
PDB files with relative distances from central atom
=env11.pdb
REFERENCE_12
PDB files with relative distances from central atom
=env12.pdb
REFERENCE_13
PDB files with relative distances from central atom
=env13.pdb
REFERENCE_14
PDB files with relative distances from central atom
=env14.pdb
REFERENCE_15
PDB files with relative distances from central atom
=env15.pdb
REFERENCE_16
PDB files with relative distances from central atom
=env16.pdb
REFERENCE_17
PDB files with relative distances from central atom
=env17.pdb
REFERENCE_18
PDB files with relative distances from central atom
=env18.pdb
REFERENCE_19
PDB files with relative distances from central atom
=env19.pdb
REFERENCE_20
PDB files with relative distances from central atom
=env20.pdb
REFERENCE_21
PDB files with relative distances from central atom
=env21.pdb
REFERENCE_22
PDB files with relative distances from central atom
=env22.pdb
REFERENCE_23
PDB files with relative distances from central atom
=env23.pdb
REFERENCE_24
PDB files with relative distances from central atom
=env24.pdb
REFERENCE_25
PDB files with relative distances from central atom
=env25.pdb
REFERENCE_26
PDB files with relative distances from central atom
=env26.pdb
REFERENCE_27
PDB files with relative distances from central atom
=env27.pdb
REFERENCE_28
PDB files with relative distances from central atom
=env28.pdb
MORE_THAN
calculate the number of variables that are more than a certain target value
={CUBIC D_0=0.83000 D_MAX=0.83001}
MEAN
calculate the mean of all the quantities
... ENVIRONMENTSIMILARITY