[gmx-users] Calculation chi angle for tryptophan residue

David van der Spoel spoel at xray.bmc.uu.se
Sat Oct 27 16:25:38 CEST 2018


Den 2018-10-25 kl. 17:13, skrev Muhammad Harith Zulkifli:
> Hi,
> 
> How can I plot a graph of chi angle of tryptohan residue over time from my
> trajectory file?
> 
> What is the suitable command?
gmx angle -type dihedral -h

> 
> Thank you.
> 
> 
> Regards,
> 
> Muhammad Harith bin Zulkifli
> 
> Tel:013-9307882
> E-mail: hzul92 at gmail.com
> 


-- 
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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