X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2Fnew%2Fmicrocanonical%2FRESPA%2Fff_1l2y%2F1L2Y_micro.inp;h=abdeb8038ec067683632ecef2fb90481eb929730;hb=59ccb87ee3cf984f400f362969613623be319541;hp=d857f25c3016a04707073ab084d9704787dff3fe;hpb=7f0d0e5fd989a56e8e969b0ead7aef311b290f51;p=unres.git

diff --git a/examples/unres/new/microcanonical/RESPA/ff_1l2y/1L2Y_micro.inp b/examples/unres/new/microcanonical/RESPA/ff_1l2y/1L2Y_micro.inp
index d857f25..abdeb80 100644
--- a/examples/unres/new/microcanonical/RESPA/ff_1l2y/1L2Y_micro.inp
+++ b/examples/unres/new/microcanonical/RESPA/ff_1l2y/1L2Y_micro.inp
@@ -1,7 +1,7 @@
 1L2Y microcanonical simulation with A-MTS algorithm in ff_1l2y
 SEED=-3059743 PDBREF MD EXTCONF RESCALE_MODE=2 RESPA
-nstep=1000000 ntwe=10000 ntwx=10000 dt=0.10 damax=10.0 lang=0 tbf              &
-tau_bath=1.0 t_bath=300 reset_vel=10000 respa ntime_split=1 maxtime_split=512  
+nstep=1000000 ntwe=10000 ntwx=10000 dt=0.10 damax=10.0 lang=0                  &
+tau_bath=1.0 t_bath=300 reset_vel=0 respa ntime_split=1 maxtime_split=512  
 WLONG=1.00000 WSCP=1.23315 WELEC=0.84476 WBOND=1.00000 WANG=0.62954            &
 WSCLOC=0.10554 WTOR=1.84316 WTORD=1.26571 WCORRH=0.19212 WCORR5=0.00000        &
 WCORR6=0.00000 WEL_LOC=0.37357 WTURN3=1.40323 WTURN4=0.64673 WTURN6=0.00000    &