5 [ ! -d $1 ] && mkdir $1
21 if [ "$?" == "0" ]; then
24 # whole simulation cell
25 #./visualize -w 640 -h 480 -d $1
28 #./visualize -w 640 -h 480 -d $1 \
29 # -nll -2.4 -2.4 -2.4 -fur 3.8 3.8 3.8 \
30 # -b -2.03 -2.03 -2.03 3.39 3.39 3.39 \
31 # -r 0.6 -c 0.5 -11.0 2.5 -B 0.1
34 #rasmol -32 -nodisplay < $1/visualize.scr > /dev/null 2>&1
37 # copy config and main prog
39 cp -v config.h $1/config.h