[AMBER] mmpbsa issues

From: Neha Gandhi <n.gandhiau.gmail.com>
Date: Tue, 30 Aug 2011 14:43:25 +0800

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
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Received on Tue Aug 30 2011 - 00:00:03 PDT
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