Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / MD / ff_1l2y_1le1 / MREMD / 1L2Y_MREMD.inp

diff --git a/examples/unres/MD/ff_1l2y_1le1/MREMD/1L2Y_MREMD.inp b/examples/unres/MD/ff_1l2y_1le1/MREMD/1L2Y_MREMD.inp
deleted file mode 100644 (file)
index e027b17..0000000
--- a/examples/unres/MD/ff_1l2y_1le1/MREMD/1L2Y_MREMD.inp
+++ /dev/null
@@ -1,18 +0,0 @@
-1L2Y
-SEED=-3059743 PDBREF RE EXTCONF
-nstep=200000  ntwe=20000 ntwx=20000 dt=0.10 damax=10000.0 lang=0 tbf           &
-tau_bath=1.0 t_bath=300 RESPA
-nrep=16 nstex=20000 tlist mlist traj1file rest1file sync nsyn=20000 
-    2    2    2    2    2    2    2    2    2    2    2    2    2    2    2    2  
-  250  260  270  280  290  300  310  320  330  340  350  360  370  380  390  400
-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    &
-WVDWPP=0.23173 WHPB=1.00000 WSCCOR=0.0                                         &
-CUTOFF=7.00000 WCORR4=0.00000
-1L2Y.pdb
-22
- D   ASN LEU TYR ILE GLN TRP LEU LYS ASP GLY GLY PRO SER SER GLY ARG PRO PRO PRO
- SER D  
- 0
- 0