dynamic disulfides are working again in md

[unres.git] / examples / unres / new / MD / DYN_SS / no_ss / small.inp

diff --git a/examples/unres/new/MD/DYN_SS/no_ss/small.inp b/examples/unres/new/MD/DYN_SS/no_ss/small.inp
index 085e3ca..2091e89 100644 (file)
--- a/examples/unres/new/MD/DYN_SS/no_ss/small.inp
+++ b/examples/unres/new/MD/DYN_SS/no_ss/small.inp
@@ -1,7 +1,7 @@
 small
 SEED=-1111333 MD ONE_LETTER
 nstep=50000  dt=0.1 ntwe=1000  ntwx=300   lang=0 tbf tau_bath=1.0 t_bath=400   &
-reset_moment=1000 reset_vel=0 damax=5.0 eq_time=1000 MDPDB
+reset_moment=1000 reset_vel=0 damax=5.0 eq_time=1000 MDPDB PRINT_COMPON
 WSC=1.00000 WSCP=2.79405 WELEC=0.14581 WANG=1.95684 WSCLOC=0.17010             &
 WTOR=2.04698 WTORD=1.69624 WCORRH=1.84615 WCORR5=0.02730 WCORR6=0.00741        &
 WEL_LOC=1.21837 WTURN3=2.91386 WTURN4=0.73178 WTURN6=0.02391 WBOND=1.0         &