Computational chemistry softwares orphaned in F20

Susi Lehtola jussilehtola at fedoraproject.org
Fri May 16 16:02:28 UTC 2014


On Fri, 16 May 2014 08:26:23 -0300
Henrique Junior <henriquecsj at gmail.com> wrote:
> 2014-05-16 6:23 GMT-03:00 Susi Lehtola <jussilehtola at fedoraproject.org>:
> > Computational chemistry is by no means dead. There are big packages
> > available for real calculations, e.g. NWChem and PSI4 are available in
> > Fedora.
> 
> I have to disagree with you. Computational chemistry is not dead and I know
> lots of chemists doing a great job in this area (both organic and
> inorganic). MOPAC7 is still in good shape despite the age.
 
That's not what I said.

Also, I'm active in the field of computational chemistry myself.
-- 
Susi Lehtola
Fedora Project Contributor
jussilehtola at fedoraproject.org


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