[gmx-users] Verify if position restrain was applied
David van der Spoel
spoel at xray.bmc.uu.se
Mon Oct 26 21:02:31 CET 2015
On 26/10/15 20:58, Ebert Maximilian wrote:
> Dear list,
> I wanted to know if there is a way to verify if the position restrain was applied correctly to the atoms in question. Couldn’t find anything in the log file.
How about position restraint energy?
> Thank you,
David van der Spoel, Ph.D., Professor of Biology
Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone: +46184714205.
spoel at xray.bmc.uu.se http://folding.bmc.uu.se
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