X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=ctest%2Fdock%2Fcluster.inp;h=0e562d5d589a5481e787d172600e63e5e2e1f95e;hb=ebc6bea71fff22edef1e69f813c050510fdce00f;hp=4434d1e49a37bf7478ce8ec5257a3fad85151c17;hpb=9871d519471d253de8e09bc983cb395dc7a95173;p=unres.git

diff --git a/ctest/dock/cluster.inp b/ctest/dock/cluster.inp
index 4434d1e..0e562d5 100644
--- a/ctest/dock/cluster.inp
+++ b/ctest/dock/cluster.inp
@@ -1,6 +1,6 @@
 2wfu UNRES-Dock 
-nres=49 one_letter rescale=2 PRINT_CART PDBOUT=1 iopt=1 temper=280.0           &
- CONSTR_HOMOL=8                                                                &
+nres=49 one_letter rescale=2 PRINT_CART PDBOUT=1 iopt=1 temper=280.0  ncut=0   &
+ CONSTR_HOMOL=8 pdbref                                                         &
 BOXX=78.90 BOXY=78.90 BOXZ=78.90
 WSC=1.00000 WSCP=1.23315 WELEC=0.84476 WBOND=1.00000 WANG=0.62954              &
 WSCLOC=0.10554 WTOR=1.34316 WTORD=1.26571 WCORRH=0.19212 WCORR5=0.00000        &
@@ -19,3 +19,4 @@ model05.pdb
 model06.pdb
 model07.pdb
 model08.pdb
+plik1ter.pdb