X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FCSA%2FCASP3%2FENERGY%2Funres_casp3.csh;h=e414f04a032662c7534f17afd8feb54b822aa339;hb=dbde27db51588de3334c01042d38d8ee5aac683c;hp=96e24d3d71b63449a5e35426e75fd44747c46dc9;hpb=bc8826038ee36f9d7f1d6dd89c90601b2562c0af;p=unres.git

diff --git a/examples/unres/CSA/CASP3/ENERGY/unres_casp3.csh b/examples/unres/CSA/CASP3/ENERGY/unres_casp3.csh
index 96e24d3..e414f04 100755
--- a/examples/unres/CSA/CASP3/ENERGY/unres_casp3.csh
+++ b/examples/unres/CSA/CASP3/ENERGY/unres_casp3.csh
@@ -5,9 +5,10 @@
 setenv POT LJ
 setenv PREFIX protA
 
-set DD = ../../PARAM
-set BIN = $HOME/UNRES/NEW/bin/unres_ifc6_cryst_tor.exe
+set DD = ../../../../../PARAM
+set BIN = ../../../../../bin/unres/CSA/unres_csa-CASP3_ifort_mpich-1.2.7p1.exe
 #---------------------------------
+setenv BONDPAR $DD/bond.parm
 setenv THETPAR $DD/thetaml.5parm
 setenv ROTPAR $DD/scgauss.parm
 setenv TORPAR $DD/torsion_cryst.parm
@@ -16,10 +17,12 @@ setenv ELEPAR $DD/electr.parm
 setenv SIDEPAR $DD/scinter_$POT.parm
 setenv FOURIER $DD/fourier_GAP.parm
 setenv SCPPAR $DD/scp.parm
+setenv FOURIER $DD/fourier_GAP.parm
+setenv SCCORPAR $DD/rotcorr_AM1.parm
 
 # Pattern database
 setenv PATTERN $DD/patterns.cart
 #--------------------------------------------
 
-$BIN -p4wd `pwd`
+$BIN $*