[gmx-users] missing atoms in residues

Bratin Kumar Das 177cy500.bratin at nitk.edu.in
Wed Oct 24 08:37:53 CEST 2018


Use whatif server to complete ur structure

On Wed, Oct 24, 2018, 11:57 AM Rahma Dahmani <rahma.dahmani at fst.utm.tn>
wrote:

> Hi everyone,
> I have one question: Is it possible to add missing atoms in residues using
> gromacs ? ( PS. i already tried pdb2gmx but it didn't work out)
> missing atoms are :
> GLU A  117    CB   CG   CD   OE1  OE2
> PRO A  158    CB   CG   CD
>
> Thank you!
> --
>
>
>
>
>
>
> *Rahma Dahmani Doctorante en CHIMIE Unité de Recherche: Physico-Chimie des
> Matériaux à l'état condensé, Laboratoire de Chimie Théorique et
> Spectroscopie MoléculaireUniversité de Tunis El Manar, Faculté des Sciences
> de Tunis Campus Universitaire Farhat Hached - BP n ° 94 - Rommana 1068,
> Tunisie Tél: (+216) 28151042*
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-request at gromacs.org.


More information about the gromacs.org_gmx-users mailing list