Hi,
In a similar case, I modified the mm_pbsa.pl script to just calculate the
statistics from the data available. The modified version is attached, I hope
it helps.
Miguel
2008/5/23 <luzhenw1.msu.edu>:
> Hi, all:
>
> I have a question about mmpbsa. since the current mm_pbsa.pl script is
> not parallel, I tried to run several mmpbsa for one complex trajectory. the
> question is, after I finished the calculation for all the snapshots, how can
> I combine all the output files together to generate statistics.out file? I
> noticed that there is one statistics.in file, however, it seems not
> useful. Thanks.
>
>
>
>
>
> Sent Via State-Mail <http://www.state-mail.com>. *MSU Students*, log in
> now at http://www.State-Mail.com
>
--
http://www.pangea.org/mol/spip.php?rubrique2
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
Je suis de la mauvaise herbe,
Braves gens, braves gens,
Je pousse en liberté
Dans les jardins mal fréquentés!
Georges Brassens
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Received on Sun May 25 2008 - 06:08:05 PDT
