Project ID: plumID:21.033
Source: inside_path/plumed.10.dat
Originally used with PLUMED version: 2.6
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr
INCLUDEIncludes an external input file, similar to #include in C preprocessor. More details. Show included fileFILE=../base.datfile to be includedPATHCVLABEL=pcv ARG=cBR,sBR,tBF INFILE=in_cycle10.input HALFLIFE=-1 PACE=500 WALKERS_RSTRIDE=500 WALKERS_ID=10 WALKERS_N=12 WALKERS_DIR=in1This action is not part of PLUMED and was included by using a LOAD command More details
c:CONSTANTCreate a constant value that can be passed to actions More detailsVALUE=-1 s:the single number that you would like to storeCOMBINECalculate a polynomial combination of a set of other variables. More detailsARG=pcv.s,cthe input to this functionCOEFFICIENTS=2.,1the coefficients of the arguments in your functionPERIODIC=-1,1if the output of your function is periodic then you should specify the periodicity of the functionUPPER_WALLSDefines a wall for the value of one or more collective variables, More detailsARG=pcv.zthe arguments on which the bias is actingAT=0.0the positions of the wallKAPPA=50.0the force constant for the wallEXP=2the powers for the wallsEPS=1the values for s_i in the expression for a wallOFFSET=0the offset for the start of the wallLABEL=tubea label for the action so that its output can be referenced in the input to other actionsMOVINGRESTRAINT...Add a time-dependent, harmonic restraint on one or more variables. More detailsVERSE=BTells plumed whether the restraint is only acting for CV larger (U) or smaller (L) than the restraint or whether it is acting on both sides (B)LABEL=steera label for the action so that its output can be referenced in the input to other actionsARG=sthe input for this action is the scalar output from one or more other actionsSTEP0=00000This keyword appears multiple times as STEP$x$ with x=0,1,2,AT0=0.0AT$x$ is equal to the position of the restraint at time STEP$x$KAPPA0=5000.0KAPPA$x$ is equal to the value of the force constants at time STEP$x$STEP1=10000This keyword appears multiple times as STEP$x$ with x=0,1,2,AT1=-0.5 ... MOVINGRESTRAINTAT$x$ is equal to the position of the restraint at time STEP$x$MOVINGRESTRAINT...Add a time-dependent, harmonic restraint on one or more variables. More detailsVERSE=BTells plumed whether the restraint is only acting for CV larger (U) or smaller (L) than the restraint or whether it is acting on both sides (B)LABEL=repela label for the action so that its output can be referenced in the input to other actionsARG=tBFthe input for this action is the scalar output from one or more other actionsSTEP0=00000This keyword appears multiple times as STEP$x$ with x=0,1,2,AT0=0.0AT$x$ is equal to the position of the restraint at time STEP$x$KAPPA0=5000.0KAPPA$x$ is equal to the value of the force constants at time STEP$x$STEP1=10000This keyword appears multiple times as STEP$x$ with x=0,1,2,AT1=0.0 ... MOVINGRESTRAINTAT$x$ is equal to the position of the restraint at time STEP$x$
#FLUSH STRIDE=500Print quantities to a file. More detailsARGthe input for this action is the scalar output from one or more other actionsSTRIDE=10the frequency with which the quantities of interest should be outputFILE=in1/COLVARthe name of the file on which to output these quantities