[gmx-users] COMMAND IN HBOND

Neha Gupta nehaphysics17 at gmail.com
Sat Mar 25 13:54:07 CET 2017


Thank you for the response.

Can you please send the url link for the location of the script (to
calculate the percentage of hydrogen bond)?

Thanks,
Neha

On Sat, Mar 25, 2017 at 1:36 PM, Tasneem Kausar <tasneemkausar12 at gmail.com>
wrote:

> If you want to calculate hydrogen bond invloving residue there are two
> steps
> From gmx hbond you can obtain an xpm file where hydrogen bond existance mad
> is plotted.  Then calculate the percentage of hydrogen bond involving
> residues from script given by justin.
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