X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FCSA%2FGAB%2FCSA%2Fglobal%2Funrestrained%2Freminimize%2Frun;fp=examples%2Funres%2FCSA%2FGAB%2FCSA%2Fglobal%2Funrestrained%2Freminimize%2Frun;h=21247ffe97cdc9b843977484a4f86253546fe432;hb=47f77d0040bb7b3315692741301cc67b5c6d481b;hp=0000000000000000000000000000000000000000;hpb=c6e5cc1ecf0804cd5d7fe0f5d4d9ba18aee74e30;p=unres.git

diff --git a/examples/unres/CSA/GAB/CSA/global/unrestrained/reminimize/run b/examples/unres/CSA/GAB/CSA/global/unrestrained/reminimize/run
new file mode 100755
index 0000000..21247ff
--- /dev/null
+++ b/examples/unres/CSA/GAB/CSA/global/unrestrained/reminimize/run
@@ -0,0 +1,11 @@
+#PBS -N unres_csa_dfa
+#PBS -q special
+#PBS -l nodes=2:ppn=4
+
+set NPROCS=`cat $PBS_NODEFILE | wc -l`
+
+cd $PBS_O_WORKDIR             
+
+/users/local/mpich-1.2.7p1_intel-10.1_em64_ssh/bin/mpirun -machinefile $PBS_NODEFILE -np $NPROCS \
+-p4wd $PBS_O_WORKDIR $PBS_O_WORKDIR/unres_4P.csh 
+