Project ID: plumID:19.076
Source: Pulling/001010/pleq1
Originally used with PLUMED version: 2.1
Stable: raw zipped stdout - stderr
Master: raw zipped stdout - stderr
# Adapt units to LAMMPS script (units real) UNITS LENGTH=A TIME=fs ENERGY=kcal/mol # Radius of Gyration rg: GYRATION TYPE=RADIUS ATOMS=1-293 restr: ... MOVINGRESTRAINT ARG=rg STEP0=0 AT0=32.6668 KAPPA0=10 STEP1=1 AT1=32.6668 KAPPA1=10 ... # Print rg PRINT ARG=rg,restr.rg_cntr,restr.rg_work FILE=workeq1 STRIDE=100000 # End of Program ENDPLUMED