Avogadro libraries for computational chemistry
Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.
http://openchemistry.org/avogadro2
- Devel package for openSUSE:Factory
-
2
derived packages
- Download package
-
Checkout Package
osc -A https://api.opensuse.org checkout science/avogadrolibs && cd $_ - Create Badge
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Source Files
| Filename | Size | Changed |
|---|---|---|
| Fix_qtplugins_surfaces_linking.patch | 0000000789 789 Bytes | |
| avogadrolibs-1.97.0.tar.gz | 0011456702 10.9 MB | |
| avogadrolibs.changes | 0000006428 6.28 KB | |
| avogadrolibs.spec | 0000006659 6.5 KB | |
|
crystals-4b39c77ec1043cfb7a73e7b5dd51e24d36a95c44. |
0000157477 154 KB | |
|
molecules-b1e16c5dc6d15e72d30dd6c4fca31b2c12025efc |
0000207244 202 KB | |
| not-install-gwavi.patch | 0000000950 950 Bytes |
Revision 13 (latest revision is 16)
Atri Bhattacharya (badshah400)
accepted
request 1003700
from
Stefan Brüns (StefanBruens)
(revision 13)
- Update to 1.97.0
https://github.com/OpenChemistry/avogadrolibs/releases/tag/1.97.0
Highlights:
* Adds molecular surfaces, solvent-accessible, and
solvent-excluded surfaces
* Adds support for a range of partial charge models, including
coloring electrostatic potentials on surfaces.
* This includes writing Python scripts to assign atomic charges
or electrostatic potential
* Adds improved hydrogen-bond, chalcogen, and halogen bond
rendering.
* Add improved close-contact and salt-bridge rendering
* Significantly improves interface translation, properly loading
translation files, and including a dialog to choose your
preferred user interface language
- Add Fix_qtplugins_surfaces_linking.patch
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