Project ID: plumID:21.033
Source: outside_path/plumed.0.dat
Originally used with PLUMED version: 2.6
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 onv2.10
tested onmaster
tested on master
INCLUDE
Includes an external input file, similar to #include in C preprocessor. More details. Show included file
FILE
file to be included
=../base.dat

PATHCV
This action is not part of PLUMED and was included by using a LOAD command More details
LABEL=pcv ARG=cBR,sBR,tBF INFILE=in_cycle.input HALFLIFE=10000 PACE=500 WALKERS_RSTRIDE=500 WALKERS_ID=0 WALKERS_N=12 WALKERS_DIR=out1
c:
CONSTANT
Create a constant value that can be passed to actions More details
VALUE
the single number that you would like to store
=-1 s:
COMBINE
Calculate a polynomial combination of a set of other variables. More details
ARG
the values input to this function
=pcv.s,c
COEFFICIENTS
the coefficients of the arguments in your function
=2.,1
PERIODIC
if the output of your function is periodic then you should specify the periodicity of the function
=-1,1
UPPER_WALLS
Defines a wall for the value of one or more collective variables, More details
ARG
the arguments on which the bias is acting
=pcv.z
AT
the positions of the wall
=0.0
KAPPA
the force constant for the wall
=50.0
EXP
the powers for the walls
=2
EPS
the values for s_i in the expression for a wall
=1
OFFSET
the offset for the start of the wall
=0
LABEL
a label for the action so that its output can be referenced in the input to other actions
=tube
METAD
Used to performed metadynamics on one or more collective variables. More details
LABEL
a label for the action so that its output can be referenced in the input to other actions
=metad
ARG
the labels of the scalars on which the bias will act
=s
HEIGHT
the heights of the Gaussian hills
=0.05
SIGMA
the widths of the Gaussian hills
=0.1
GRID_MIN
the lower bounds for the grid
=-1
GRID_MAX
the upper bounds for the grid
=1
PACE
the frequency for hill addition
=500
WALKERS_RSTRIDE
stride for reading hills files
=500
WALKERS_ID
walker id
=0
WALKERS_N
number of walkers
=9
WALKERS_DIR
shared directory with the hills files from all the walkers
=out1
#FLUSH STRIDE=500
PRINT
Print quantities to a file. More details
ARG
the labels of the values that you would like to print to the file
STRIDE
the frequency with which the quantities of interest should be output
=10
FILE
the name of the file on which to output these quantities
=out1/COLVAR