PLUMED-NEST

Project ID: plumID:19.015
Source: surface/100_polar/plumed_restart.dat
Originally used with PLUMED version: 2.3
Stable: raw zipped stdout - stderr
Master: raw zipped stdout - stderr

#torsion1 between vector C1,C2 and C10,C11 with axis C2,C10
t1: TORSION VECTOR1=895,894 AXIS=895,903 VECTOR2=903,904

#torsion2 between vector C7,C10 and C11,C12 with axis C10,C11
t2: TORSION VECTOR1=903,900 AXIS=903,904 VECTOR2=904,905

#metadynamics
METAD ...
ARG=t1,t2
SIGMA=0.1,0.1
HEIGHT=0.96
PACE=500
BIASFACTOR=10.0
TEMP=300.0
LABEL=metad
FILE=HILLS
GRID_MIN=-pi,-pi
GRID_MAX=pi,pi
GRID_BIN=350,350
... METAD

PRINT ARG=t1,t2,metad.bias STRIDE=100 FILE=COLVAR