X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2Fnew%2FMD%2FBerendsen%2Fff_gab%2Funres.csh;fp=examples%2Funres%2Fnew%2FMD%2FBerendsen%2Fff_gab%2Funres.csh;h=2652ea22fc7b639b7a5c58465559b1c6f146fbce;hb=39bffec2e960cdaa362c075425c0aa94bbd673c9;hp=c98ab23c15bf2690832601555d5e1010d0de6fb0;hpb=036e8e1e671a1293c1f636d9246e3dfd74f38ec1;p=unres.git

diff --git a/examples/unres/new/MD/Berendsen/ff_gab/unres.csh b/examples/unres/new/MD/Berendsen/ff_gab/unres.csh
index c98ab23..2652ea2 100755
--- a/examples/unres/new/MD/Berendsen/ff_gab/unres.csh
+++ b/examples/unres/new/MD/Berendsen/ff_gab/unres.csh
@@ -4,9 +4,10 @@ setenv POT GB
 setenv PREFIX 1L2Y_MD
 setenv OUT1FILE YES
 #-----------------------------------------------------------------------------
-setenv UNRES_BIN /users/adam/unres/bin/unres/MD/unres_ifort_MPICH_GAB.exe
+#setenv UNRES_BIN /users/adam/unres/bin/unres/MD/unres_ifort_MPICH_GAB.exe
+setenv UNRES_BIN /users/pk376/unres-git/unres/bin/unres/MD/unres_ifort_MPICH_GAB.exe
 #-----------------------------------------------------------------------------
-setenv DD /users/aks255/newUNRES/unres/PARAM
+setenv DD /users/pk376/unres-git/unres/PARAM
 setenv BONDPAR $DD/bond.parm
 setenv THETPAR $DD/thetaml.5parm
 setenv ROTPAR $DD/scgauss.parm
@@ -15,8 +16,8 @@ setenv TORDPAR $DD/torsion_double_631Gdp.parm
 setenv ELEPAR $DD/electr_631Gdp.parm
 setenv SIDEPAR $DD/sc_GB_opt.1e0g-52-17k-2k-newclass-shan1e9_gap8g-sc
 setenv FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
-setenv SCCORPAR $DD/rotcorr_AM1.parm
-#setenv SCCORPAR $DD/sccor_pdb_shelly.dat
+#setenv SCCORPAR $DD/rotcorr_AM1.parm
+setenv SCCORPAR $DD/sccor_pdb_shelly.dat
 setenv SCPPAR $DD/scp.parm
 setenv PATTERN $DD/patterns.cart
 #-----------------------------------------------------------------------------