|
i=4
temp=30
temp_to=62 #iteration number
while [ $temp != $temp_to ]
do
rm all_${temp}.txt
sed -e "7cmol new {H:\PRL_data\data\cone_two_new4\\${temp}\gro\gb.gro} type {gro} first 0 last -1 step 1" all.txt > all_${temp}_1.txt &
wait
sed -e "8cset num_molecular $i" all_${temp}_1.txt > all_${temp}.txt &
echo $temp
wait
# calu temp
rm all_${temp}_1.txt
i=`expr $i + 1`
temp=`expr $temp + 2`
done
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