Re: [AMBER] mmpbsa issues

From: <sribone.fcq.unc.edu.ar>
Date: Tue, 30 Aug 2011 09:07:36 -0300

Dear Neha, you have the answer in the amberlist:

http://archive.ambermd.org/200407/0279.html

Regards,

> Dear list,
>
>
> I am running MM-PBSA using perl script in AMBER11. The job halted after
> generating snapshots. At first I thought, it might be the improper numbering
> with coordinates, but I verified the coordinates. I get following message.
>
> --------------------------------------------------------------------------------
> 4. RESULTS
> --------------------------------------------------------------------------------
>
> PB bomb in pb_reslist(): maxnbr too small
>
>
> Your help is appreciated.
> --
> Regards,
> Neha Gandhi,
> School of Biomedical Sciences,
> Curtin University of Technology,
> GPO Box U1987 Perth,
> Western Australia 6845
> Phone: 9266 9061
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber
>



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Received on Tue Aug 30 2011 - 05:30:02 PDT
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