Merge branch 'prerelease-3.2.1' into czarek

[unres.git] / examples / unres / MD / ff_gab / unres.csh

diff --git a/examples/unres/MD/ff_gab/unres.csh b/examples/unres/MD/ff_gab/unres.csh
deleted file mode 100755 (executable)
index 82b2f43..0000000
--- a/examples/unres/MD/ff_gab/unres.csh
+++ /dev/null
@@ -1,31 +0,0 @@
-#!/bin/csh -f
-# Script to run the program unresCSA on linux with MPICH/PBS (parallel version).
-#
-
-setenv OUT1FILE YES
-setenv FGPROCS 1
-setenv POT GB
-setenv PREFIX 1L2Y_minim
-
-set DD = /users/adam/UNRES/PARAM
-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_single_GAB.exe
-#---------------------------------
-setenv BONDPAR $DD/bond.parm 
-setenv THETPAR $DD/thetaml.5parm
-setenv ROTPAR $DD/scgauss.parm
-setenv TORPAR $DD/torsion_631Gdp.parm
-setenv TORDPAR $DD/torsion_double_631Gdp.parm
-setenv ELEPAR $DD/electr_631Gdp.parm
-setenv SIDEPAR ${DD}/sc_GB_opt.1gab_3S_qclass5no310-shan2-sc-16-10-8k
-#setenv SIDEPAR ${DD}/scinter_LJ.parm
-setenv FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
-setenv SCPPAR $DD/scp.parm
-setenv SCCORPAR $DD/rotcorr_AM1.parm
-
-# Pattern database
-setenv PATTERN $DD/patterns.cart
-#--------------------------------------------
-
-$UNRES_BIN $*
-