Re: [AMBER] mmpbsa not included in Amber11?

From: Jason Swails <jason.swails.gmail.com>
Date: Thu, 27 Jun 2013 23:00:40 -0400

On Thu, Jun 27, 2013 at 10:55 PM, Changqing Yan <ycqchemical.gmail.com>wrote:

> Dear Amber experts,
>
> It seems that the python script mm_pbsa.py is not included in amber11
> files. All I found are MMPBSA, MMPBSA.MPI, mm_pbsa.pl. What should I do?
>

MMPBSA and MMPBSA.MPI are MMPBSA.py and MMPBSA.py.MPI, respectively (but
very old versions). I highly suggest you upgrade to AmberTools 13 (it can
be installed and used alongside Amber 11).

All the best,
Jason 

-- 
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
352-392-4032
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Received on Thu Jun 27 2013 - 20:30:03 PDT
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