[gmx-users] residues interaction with ligand

Venkat Reddy venkat4bt at gmail.com
Mon May 20 13:23:08 CEST 2013


You can use g_select utility.
For more details check the following link
http://www.gromacs.org/Documentation/Gromacs_Utilities/g_select


On Sun, May 19, 2013 at 1:20 PM, Arunima Shilpi <writetoash28 at gmail.com>wrote:

> Respected Sir
>
> If we have to find the residues surrounding the ligand in protein ligand
> complex... than which gromacs command should be used...
>
> Looking forward for your reply.............
>
> --
>
> Thanking You with Regards.
>
> Arunima Shilpi
>
> Ph. D Research Scholar(Cancer & Epigenetics)
> Department of Life Science
> National Institute of Technology
> Rourkela
> Odisha
> --
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-- 
With Best Wishes
Venkat Reddy Chirasani
PhD student
Laboratory of Computational Biophysics
Department of Biotechnology
IIT Madras
Chennai
INDIA-600036



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