X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=ctest%2Fdfa%2Fdfa_wham.inp;h=5461a8193cf21852ee2002db0792696187e8184e;hb=7539681341135ab1930fda04350474a8eb5748fe;hp=de0dde27dc9acfe624acda7e684708408bae7f8e;hpb=97e40e38fb2fdee7df966a912b12f4c6754b41ce;p=unres.git diff --git a/ctest/dfa/dfa_wham.inp b/ctest/dfa/dfa_wham.inp index de0dde2..5461a81 100644 --- a/ctest/dfa/dfa_wham.inp +++ b/ctest/dfa/dfa_wham.inp @@ -1,4 +1,4 @@ -SEED=-3059743 n_ene=26 isampl=1 nparmset=1 nq=1 einicheck=1 & +SEED=-3059743 isampl=1 nparmset=1 nq=1 einicheck=1 & rescale=2 ensembles=0 cxfile delta=0.02 nslice=1 CONSTR_HOMOL=8 WDFAD=1.5 WDFAT=0.75 WDFAN=1.4 WDFAB=1.0 & nres=77 one_letter