more interstitial testing, added bond visualization

[physik/posic.git] / run

diff --git a/run b/run
index c7d454c..bd72bc2 100755 (executable)
--- a/run
+++ b/run
@@ -4,7 +4,8 @@
 if [ "$?" == "0" ]; then
        #./perms
        if [ "$1" ] ; then
-               ./visualize -d $1
+               #./visualize -w 640 -h 480 -d $1
+               ./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 1.5 -15.0 1.5
                #rasmol -32 -nodisplay < $1/visualize.scr > /dev/null 2>&1
                ./ppm2avi $1
        fi