ctest wsccor 0.25 wtor 1.34316 in all tests
[unres.git] / ctest / prota_MIN_CART.inp
index f04fc51..7d1f3a0 100644 (file)
@@ -3,9 +3,9 @@ SEED=-3059743 minimize pdbstart pdbref refstr rescale_mode=2 cart overlap      &
 nosearchsc
 print_min_ini print_min_res print_min_stat MAXMIN=10000 MAXFUN=15000
 WLONG=1.00000 WSCP=1.23315 WELEC=0.84476 WBOND=1.00000 WANG=0.62954            &
-WSCLOC=0.10554 WTOR=1.84316 WTORD=1.26571 WCORRH=0.19212 WCORR5=0.00000        &
+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=0.0                                         &
+WVDWPP=0.23173 WHPB=1.00000 WSCCOR=0.25                                        &
 CUTOFF=7.00000 WCORR4=0.00000
 prota.pdb
  0