[gmx-users] Issue with the PDB generated after topology

João Henriques joao.m.a.henriques at gmail.com
Mon Jul 3 11:54:23 CEST 2017


To renumber a gro file:

gmx editconf -resnr

OR

Script it, I'm sure there's a one liner for that in awk (even in Python
that shouldn't take more than 10 lines of code).

/J

On Mon, Jul 3, 2017 at 11:37 AM, Khadija Amine <kh.amine1 at gmail.com> wrote:

> Hi,
>
> I have already converted the .gro file to .pdb file and I'm not able
> to see the two separated chains.
>
>
> Khadija
>
>
>
>
> *Khadija Amine*
> Ph.D. Biology and Health
> Biochemistry & Bioinformatics
> Phone: 33339584
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