[gmx-users] coordinate file with charges

[Marcos Villarreal]

yes,
editconf -mead (o -grasp)


On Friday 12 March 2004 12:50, Andrea Hombrecher wrote:
> Dear GROMACS-users,
> is it possible in GROMACS to print out a coordinate file of a protein
> containing partial charges?
> Thanks in advance!
>
> Andrea
>
> --
> Andrea Hombrecher
>
> Heinrich-Heine-Universitaet Duesseldorf
> Institut fuer pharmazeutische Chemie
> Gebaeude 26.23
> Universitaetsstrasse 1
> 40225 Duesseldorf
>
>    Tel: 0211-81-13830
>    Fax: 0211-81-13847
> E-mail: hombr at pharm.uni-duesseldorf.de
>
>
>
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