AMBER: generate topology file for alanine scanning (mmpbsa)

From: <>
Date: Thu, 14 Aug 2008 15:32:56 -0400

Dear all:

     For alanine scanning in mmpbsa,  the topology file
has to be prepared for each mutant. Currently I modify
the original pdb file and use tleap to generate those
files. it is kind time-consuming for many muatants. I
wonder if anyone has better way to do it.  Thanks in





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Received on Sun Aug 17 2008 - 06:07:31 PDT
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