[gmx-users] Regarding OH, HH vector distribution

Omkar Singh omkantnirala92 at gmail.com
Mon Jul 29 18:26:37 CEST 2019


Hi,
Meaning is that If I want to calculate angle between OH, HH and dip vector
with positive Z-axis. How can I make index file for this issue? And is it
possible that the angle distribution of these vectors for bulk water
aproximatly linear. Hope now question is clear.

Thanks

On Mon, Jul 29, 2019, 16:33 David van der Spoel <spoel at xray.bmc.uu.se>
wrote:

> Den 2019-07-29 kl. 12:24, skrev Omkar Singh:
> > Hello everyone,
> > Is it possible that the probability distribution of HH, OH vector for
> bulk
> > water is approximately linear?
> >
> What do you mean?
>
> --
> David van der Spoel, Ph.D., Professor of Biology
> Head of Department, Cell & Molecular Biology, Uppsala University.
> Box 596, SE-75124 Uppsala, Sweden. Phone: +46184714205.
> http://www.icm.uu.se
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