X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2FGAB%2FCSA%2Fglobal%2Funrestrained%2Fene%2Funres_4P.csh;fp=examples%2Funres%2FCSA%2FGAB%2FCSA%2Fglobal%2Funrestrained%2Fene%2Funres_4P.csh;h=0000000000000000000000000000000000000000;hp=25e198b03b520a278f44e191ac677f1c7df0b105;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/CSA/global/unrestrained/ene/unres_4P.csh b/examples/unres/CSA/GAB/CSA/global/unrestrained/ene/unres_4P.csh deleted file mode 100755 index 25e198b..0000000 --- a/examples/unres/CSA/GAB/CSA/global/unrestrained/ene/unres_4P.csh +++ /dev/null @@ -1,24 +0,0 @@ -#!/bin/csh -setenv FGPROCS 1 -setenv POT GB -setenv PREFIX 1l2y_remini -setenv OUT1FILE NO -#----------------------------------------------------------------------------- -setenv UNRES_BIN /users/czarek/UNRES/GIT/unres/bin/unres/CSA/unres_csa_ifort_mpich-1.2.7p1.exe -#----------------------------------------------------------------------------- -setenv DD /users/czarek/UNRES/GIT/unres/PARAM -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 FOURIER $DD/fourier_opt.parm.1igd_hc_iter3_3 -setenv SCCORPAR $DD/rotcorr_AM1.parm -setenv SCPPAR $DD/scp.parm -setenv PATTERN $DD/patterns.cart -setenv PRINT_PARM NO -#----------------------------------------------------------------------------- - -$UNRES_BIN $*