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Old 06-23-2007, 10:14 AM   #1
nexisrocks
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Registered: Jun 2007
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Shell Scripting


I have no idea how to write or run a shell script, however I would like to write one that would run 288 java programs sequentially (with each outputting to a different output file.

For example, were I just to run it in bash the command I would use is:
Code:
java Grid1 < slab.gro > slab1.gro
Then the next program I would run is:
Code:
java Grid2 < slab.gro > slab2.gro
The numbers in the filenames increase sequentially up to 288, and I would like to run a shell script that will, once written, run it all for me (so I do not have to run it myself 288 times). Would I just need one line and to change the numbers on each subsequent line in the script? If that is the case, what is the line I would need? I have no experience with shell scripting, so I am unsure as how it would work.

Also, how would I run the shell script once it is written?

After that is done, I would also like to run the command:
Code:
genconf -f slab1.gro -o slab1.pdb
This would also be run 288 times, with the numbers increasing up to 288. I would run it in another shell script, as it must be done on a different server.

Any help would be really, greatly appreciated!
 
Old 06-23-2007, 10:57 AM   #2
acid_kewpie
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script.sh:
Code:
for i in $(seq 1 288)
do
  java Grid2 < slab.gro > slab${i}.gro
  genconf -f slab${i}.gro -o slab${i}.pdb
done
Code:
sh ./script.sh
 
Old 06-23-2007, 02:42 PM   #3
nexisrocks
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Registered: Jun 2007
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Oh, perfect! Thank you so much!
 
Old 06-23-2007, 09:08 PM   #4
pixellany
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Give a man a fish.........

Bash Guide for Beginners---at tldp.org
Classic Shell Scripting---O'Reilly
 
  


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