Curiously enough, this is the very first FAQ in the wiki list...
http://wiki.gromacs.org/index.php/FAQs
Mark
Venky Krishna wrote:
well I don't know if it can be done with gromacs... but sure can be
using shell script + perl script.
do something like this....
#!/usr/bin/perl
while ($i<10)
{
system ("g_dist << EOF
13
14
EOF");
$i=$i+1;
}
Venky
On Aug 22, 2007, at 7:44 AM, priyanka srivastava wrote:
Dear All,
Apologies for a very basic query.
I wish to run g_dist command using groups 13 & 14 say
10 times, when I write the perl script it prompts me
at the following point 10 times:
Select a group:
So I have to manually give 13 and 14 each time.
Is there anyway in gromacs to automate it??
Priyanka.
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