PLUMED-NEST

Project ID: plumID:24.036
Source: 2r3i/plumed.dat
Originally used with PLUMED version: 2.4
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

t0The TORSION action with label t0 calculates the following quantities:
 Quantity   
 Type   
 Description  
t0
scalar
the TORSION involving these atoms: TORSIONCalculate one or multiple torsional angles. More details ATOMSthe four atoms involved in the torsional angle=4854,4855,4859,4867

#MOVINGRESTRAINT ...
#   ARG=t0
#   STEP0=0     AT0=-1.0  KAPPA0=0 
#   STEP1=1000  AT1=-1.0  KAPPA1=1000
#...

PRINTPrint quantities to a file. More details ARGthe labels of the values that you would like to print to the file=* FILEthe name of the file on which to output these quantities=COLVAR  STRIDE the frequency with which the quantities of interest should be output=1