[AMBER] convert psf to top of gmx with parmed

From: Qinghua Liao <scorpio.liao.gmail.com>
Date: Wed, 21 Jun 2017 18:42:48 +0200

Hello,

I used parmed to convert a psf file to a gromacs top file successfully,
but most of the parameters (LJ, bonded)
are missing in the top file. How could I use parmed to include the
parameters for the top file, taking the parameters
from the force field library file? Thanks a lot!


All the best,
Qinghua

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Received on Wed Jun 21 2017 - 10:00:03 PDT
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