Project ID: plumID:19.059
Source: plumed.1.dat
Originally used with PLUMED version: 2.2.3
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr
#RESTARTINCLUDEIncludes an external input file, similar to #include in C preprocessor. More details. Show included fileFILE=plumed_be-common.datfile to be included
#METAD activates metadynamics #ARG indicates variables to enhance (omega & psi) #PACE indicates frequency of Gaussian deposition is 1000 time step (2ps) #HEIGHT indicates that height of the Gaussians is 0.2 kJ/mol #SIGMA indicates the width of the Gaussians on the biased cv, respectively
be:METADUsed to performed metadynamics on one or more collective variables. More detailsARG=cv2the input for this action is the scalar output from one or more other actionsPACE=1000the frequency for hill additionHEIGHT=0.2the heights of the Gaussian hillsSIGMA=0.23the widths of the Gaussian hills
#print in other file the values of the CVS and the bias potential #STRIDE frequency of output #ARG things to print, omega, psi #FILE, name of the file to output; COLVARPrint quantities to a file. More detailsSTRIDE=500the frequency with which the quantities of interest should be outputARG=cv1,cv2the input for this action is the scalar output from one or more other actionsFILE=COLVARthe name of the file on which to output these quantities