plumed_ASN55-PRO59_avg_metadinamika.dat

bash-4.3$ cat plumed_ASN55-PRO59_avg_metadinamika.dat
#55ASN iki 59PRO imtinai
c1: CENTER ATOMS=835-910
c2: CENTER ATOMS=4508-4583
c3: CENTER ATOMS=8181-8256
c4: CENTER ATOMS=11854-11929
c5: CENTER ATOMS=15527-15602
c6: CENTER ATOMS=19200-19275

DISTANCES GROUP=c1,c2,c3,c4,c5,c6 MEAN LABEL=d1

#PACE=1 HEIGHT=1.2 SIGMA=0.7 yra ~OK
metad: METAD ARG=d1.mean PACE=1 HEIGHT=0.5 SIGMA=0.35 FILE=HILLS_55ASN-59PRO
#min/max:
#GRID_MIN=0.01 GRID_MAX=3
#wt:
#BIASFACTOR=100 TEMP=300.0

PRINT ARG=* STRIDE=10 FILE=COLVAR_55ASN-59PRO