[Chimera-users] ​New script: CREATE ALL ALTERNATIVE RECEPTOR PROTONATIONS

[Eric Pettersen]

Very nice!

—Eric

> On Mar 28, 2019, at 4:55 AM, Thomas Evangelidis <tevang3 at gmail.com> wrote:
> 
> 
> New script and tutorial: CREATE ALL ALTERNATIVE RECEPTOR PROTONATION STATE COMBINATIONS. Useful for those that do MD, docking, or any other structure-based drug design method.
> 
> https://github.com/tevang/tutorials/tree/master/create_alternative_protonations <https://github.com/tevang/tutorials/tree/master/create_alternative_protonations>
>  <https://github.com/tevang/tutorials/tree/master/create_alternative_protonations>
> -- 
> ======================================================================
> Dr Thomas Evangelidis
> Research Scientist
> IOCB - Institute of Organic Chemistry and Biochemistry of the Czech Academy of Sciences <https://www.uochb.cz/web/structure/31.html?lang=en>
> Prague, Czech Republic
>   & 
> CEITEC - Central European Institute of Technology <https://www.ceitec.eu/>
> Brno, Czech Republic 
> 
> email: tevang3 at gmail.com <mailto:tevang3 at gmail.com>
> website: https://sites.google.com/site/thomasevangelidishomepage/ <https://sites.google.com/site/thomasevangelidishomepage/>
> 
> 
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