X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=ctest%2Fprota_ENE.inp;fp=ctest%2Fprota_ENE.inp;h=debdc43df2fad1dcc4c458eb1642eed3dab670ee;hb=6d74bfa38307157b15037b211b6537fd77bbbf88;hp=0000000000000000000000000000000000000000;hpb=f526ba33b22b25a96070192e51b6f1943fb3ba3c;p=unres.git

diff --git a/ctest/prota_ENE.inp b/ctest/prota_ENE.inp
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--- /dev/null
+++ b/ctest/prota_ENE.inp
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+Test energii - 1bdd - pdbstart unres_pdb
+SEED=-3059743 energy pdbstart pdbref refstr rescale_mode=2 unres_pdb energy_dec
+WLONG=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        &
+WCORR6=0.00000 WEL_LOC=0.37357 WTURN3=1.40323 WTURN4=0.64673 WTURN6=0.00000    &
+WVDWPP=0.23173 WHPB=1.00000 WSCCOR=0.25                                        &
+CUTOFF=7.00000 WCORR4=0.00000
+prota_unres.pdb
+ 0
+ 0