X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=bin%2Funres%2FMD%2Funres.csh;fp=bin%2Funres%2FMD%2Funres.csh;h=0000000000000000000000000000000000000000;hb=0a11a2c4ccee14ed99ae44f2565b270ba8d4bbb6;hp=dfd88585b1f18dc8d386ce743a38b95d969fca7d;hpb=5eb407964903815242c59de10960f42761139e10;p=unres.git

diff --git a/bin/unres/MD/unres.csh b/bin/unres/MD/unres.csh
deleted file mode 100755
index dfd8858..0000000
--- a/bin/unres/MD/unres.csh
+++ /dev/null
@@ -1,26 +0,0 @@
-#!/bin/csh -f
-setenv FGPROCS 4
-setenv POT GB
-setenv PREFIX 1DKZ-ber-MREMD
-setenv OUT1FILE NO
-#-----------------------------------------------------------------------------
-setenv UNRES_BIN /users/adam/MEY_MD/bin/unres_Tc_procor_oldparm_em64-D-finegrain.exe
-#setenv UNRES_BIN /users/adam/MEY_MD/bin/unres_Tc_procor_oldparm_em64-finegrain.exe
-#-----------------------------------------------------------------------------
-setenv DD /users/adam/UNRES/PARAM
-setenv BONDPAR $DD/bond.parm
-setenv THETPAR $DD/thetaml.5parm
-setenv ROTPARPDB $DD/scgauss.parm
-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 FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3
-setenv SCCORPAR $DD/rotcorr_AM1.parm
-setenv SCPPAR $DD/scp.parm
-setenv PATTERN $DD/patterns.cart
-#setenv PRINT_PARM YES
-#-----------------------------------------------------------------------------
-
-$UNRES_BIN $*