From ec3cbca7c97d18e13c42ec77b351171d9a402bcf Mon Sep 17 00:00:00 2001 From: hackbard Date: Wed, 30 Jul 2008 17:36:51 +0200 Subject: [PATCH] new runmd script for the rx200 --- runmd_rx200 | 21 ++------------------- 1 file changed, 2 insertions(+), 19 deletions(-) diff --git a/runmd_rx200 b/runmd_rx200 index 9368141..4e4966e 100755 --- a/runmd_rx200 +++ b/runmd_rx200 @@ -23,22 +23,5 @@ cat > run_$rf <<-EOF EOF # submit job -qsub run_$rf - -if [ "$?" == "0" ]; then - #./perms - if [ "$1" ] ; then - # whole simulation cell - #./visualize -w 640 -h 480 -d $1 - - # center unit cell - #./visualize -w 640 -h 480 -d $1 \ - # -nll -2.4 -2.4 -2.4 -fur 3.8 3.8 3.8 \ - # -b -2.03 -2.03 -2.03 3.39 3.39 3.39 \ - # -r 0.6 -c 0.5 -11.0 2.5 -B 0.1 - - # old rasmol - #rasmol -32 -nodisplay < $1/visualize.scr > /dev/null 2>&1 - #./ppm2avi $1 - fi -fi +qsub -q all.q run_$rf + -- 2.39.2