[gmx-users] g_hbond Issues

Anil Kumar chemanil at gmail.com
Sun Sep 13 18:07:13 CEST 2009


Dear Gmx Users,

I need to calculate the H-Bonds of simulation trajectory with specification
of i to i+2/3/4/5 so on..and i to i -2/3/4/5 so on...separately.

Do anyone have any idea how to do this...since the present option g_hbond
calculate both the hydrogen bonds together irrespective of i to i+/-
2/3/4/5/6 and so on..

Or is there any other program which can be used for this analysis.

Thanks in advance,

With Regards,
Anil Kumar
IIT Bombay.
India
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