Re: [AMBER] PB Bomb in pb_atmlist(): maxnba too short

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From: manikanthan bhavaraju <manikanthanbhavaraju.gmail.com>
Date: Tue, 1 Nov 2011 20:06:53 -0500

Yes, I am using MMPBSA.py script of AmerTools1.5 to calculate PBSA and
nmode. I don't know why MMPBSA.py could calculate the GBSA and PBSA and
nmode properly for explicit solvent equilibrated .mdcrd files but not with
implicit solvent.

mani
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Received on Tue Nov 01 2011 - 18:30:03 PDT