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
ENVIRONMENTSIMILARITY...Measure how similar the environment around atoms is to that found in some reference crystal structure. More detailsSPECIES=1-1152:3this keyword is used for colvars such as coordination numberSIGMA=0.05the width to use for the gaussian kernelsCRYSTAL_STRUCTURE=CUSTOMTargeted crystal structureLABEL=refcv REPLACE_REFERENCEa label for the action so that its output can be referenced in the input to other actionsMORE_THAN1={CUBIC D_0=4.792375 D_MAX=4.888625}calculate the number of variables that are more than a certain target valueMORE_THAN2={CUBIC D_0=4.850125 D_MAX=4.850225}calculate the number of variables that are more than a certain target valueMEANcalculate the mean of all the quantitiesATOM_NAMES_FILE=ice.pdb ... ENVIRONMENTSIMILARITYPDB file with atom names for all atoms in SPECIES