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ctest UNRES-Dock update
[unres.git]
/
ctest
/
dock
/
wham.inp
diff --git
a/ctest/dock/wham.inp
b/ctest/dock/wham.inp
index
1b83d17
..
66a0ab0
100644
(file)
--- a/
ctest/dock/wham.inp
+++ b/
ctest/dock/wham.inp
@@
-38,7
+38,7
@@
nr=1 temp=330 fi=0.0 0.0 0.0 0.0 0.0
kh= 0.0 Q0=0.0
nr=1 temp=345 fi=0.0 0.0 0.0 0.0 0.0
kh= 0.0 Q0=0.0
-nfile_cx=1 rec_start=50 rec_end=500 totraj=8
+nfile_cx=1 rec_start=51 rec_end=100 totraj=8
2WFU_dock_MD000
pdbref
plik1ter.pdb