examples/unres/MD/Multichain/1DKZ-gab-ber.inp

   1 1DKZ with substrate
   2 SEED=-3059743 MD PDBSTART REFSTR PDBREF PDBOUT DISTCHAINMAX=100
   3 nstep=10000  ntwx=100 ntwe=10 dt=0.001 lang=0 tbf=1 tau_bath=1.0 t_bath=50     &
   4 MDPDB respa
   5 WLONG=1.35279 WSCP=1.59304 WELEC=0.71534 WBOND=1.00000 WANG=1.13873            &
   6 WSCLOC=0.16258 WTOR=1.98599 WTORD=1.57069 WCORRH=0.42887 WCORR5=0.00000        &
   7 WCORR6=0.00000 WEL_LOC=0.16036 WTURN3=1.68722 WTURN4=0.66230 WTURN6=0.00000    &
   8 WVDWPP=0.11371 WHPB=1.00000 WSCCOR=0.00000                                     &
   9 CUTOFF=7.00000 WCORR4=0.00000
  10 1DKZ.pdb
  11 0
  12 0