VMD-L Mailing List

From: JC Gumbart (gumbart_at_ks.uiuc.edu)
Date: Wed May 28 2014 - 06:36:31 CDT

This can happen because two residues can form more than one h-bond at once.

JC

On May 28, 2014, at 4:18 AM, bharat gupta <bharat.85.monu_at_gmail.com> wrote:

> Hi,
>
> I calculated the h-bonds of a residue during 10ns simulation and the hydrogen bond occupancy for one residue pair was 104%. What does this signify and how its calculated ??
>
> Regards
> -------
> Bharat
>