[gmx-users] Defining single, double and triple bonds

Mark Abraham mark.j.abraham at gmail.com
Thu Jan 4 09:08:07 CET 2018


Hi,

You can define bonds of different strengths, but the connectivity and
spatial arrangement are not expressed in the way you suggest.

Mark

On Thu, Jan 4, 2018 at 5:27 AM SUVANKAR GHOSH <svnkrgsh at iitg.ernet.in>
wrote:

>
> Hi, Is there any option to define single, double and triple bonds in my
> topology.
>
> --
> Suvankar Ghosh
> Research Scholar,
> Computational Structural Biology Lab,
> Dept. of Biosciences and Bioengineering (BSBE),
> Indian Institute of Technology Guwahati (IITG)
> Guwahati 781039, Assam, India
> --
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