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dist1cut statout 2 rmsd
[unres.git]
/
ctest
/
1L2Y_wham.inp
diff --git
a/ctest/1L2Y_wham.inp
b/ctest/1L2Y_wham.inp
index
96c2309
..
5b763e8
100644
(file)
--- a/
ctest/1L2Y_wham.inp
+++ b/
ctest/1L2Y_wham.inp
@@
-1,4
+1,4
@@
-SEED=-3059743 n_ene=19 isampl=1 nparmset=1 nq=1 einicheck=1 &
+SEED=-3059743 isampl=1 nparmset=1 nq=1 einicheck=1 &
rescale=2 ensembles=0 nslice=1 delta=0.02 refstr pdbref classify cxfile
nres=22 one_letter
XNLYIQWLKDGGPSSGRPPPSX