[PLUG] Linux chemistry software

tomas.kuchta.lists at gmail.com tomas.kuchta.lists at gmail.com
Tue Aug 11 23:12:13 UTC 2020


Try Avogadro, BKChem, gromacs, RasMol, PyMOL, Jmol ... GChemPaint, Ghemical, ...

I read about them in these places:
https://www.linuxjournal.com/content/gabedit-portal-chemistry
https://www.linuxjournal.com/content/study-elements-kdes-kalzium
https://www.linuxjournal.com/content/visualizing-molecules-easychem
https://www.linuxjournal.com/content/visualizing-molecules-python
https://www.linuxjournal.com/content/abinit-chemists
https://www.linuxjournal.com/content/atomic-modeling-gamgi
https://www.linuxjournal.com/content/chemistry-desktop
https://www.linuxjournal.com/content/basic-chemistry-gnome-desktop
https://www.linuxjournal.com/content/chemistry-gromacs-way


https://www.linux-magazine.com/Issues/2013/152/3D-Molecular-Visualizer

On Tue, 2020-08-11 at 15:42 -0700, Tom wrote:
> Hello,
> 
> I wanted to ask if anybody knew of some Linux software like Kalzium,
> except for dealing with compounds. It would also be really nice if it
> could simulate reactions, emphasis on electronegativity and be able to
> accurately simulate compound reactions above 13ph (so called
> superbases) and be able to take activation energies into account.
> 
> I am not aware of much chemistry software for Linux. I am particularly
> interested in researching efficient ways to store and covert chemical
> energy.
> 



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