[gmx-users] to print parameters used from force field
Mark Abraham
mark.j.abraham at gmail.com
Tue Jun 18 10:32:57 CEST 2013
Grep?
On Jun 18, 2013 10:23 AM, "gromacs query" <gromacsquery at gmail.com> wrote:
> Dear All,
>
> Is there any way to print parameters used for system (just for the
> atomtypes present in system). I have all necessary files (top, tpr, gro and
> oplsa.ff)
>
> regards,
> Jiom
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