Project ID: plumID:23.001
Source: EnhancedCoexistence/Liq-II/1-BiasedCoexistence/COEX_2000atm/240K/plumed.order.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
ENVIRONMENTSIMILARITY
Measure how similar the environment around atoms is to that found in some reference crystal structure. More details
...
SPECIES
this keyword is used for colvars such as coordination number
=1-1152:3
SIGMA
the width to use for the gaussian kernels
=0.05
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
=refcv REPLACE_REFERENCE
MORE_THAN1
calculate the number of variables that are more than a certain target value
={CUBIC D_0=4.792375 D_MAX=4.888625}
MORE_THAN2
calculate the number of variables that are more than a certain target value
={CUBIC D_0=4.850125 D_MAX=4.850225}
MEAN
calculate the mean of all the quantities
ATOM_NAMES_FILE
PDB file with atom names for all atoms in SPECIES
=ice.pdb ... ENVIRONMENTSIMILARITY