Avogadro libraries for computational chemistry

Edit Package avogadrolibs

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

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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.tar.gz 0000157477 154 KB
molecules-b1e16c5dc6d15e72d30dd6c4fca31b2c12025efc.tar.gz 0000207244 202 KB
not-install-gwavi.patch 0000000950 950 Bytes
Revision 13 (latest revision is 16)
Atri Bhattacharya's avatar Atri Bhattacharya (badshah400) accepted request 1003700 from Stefan Brüns's avatar 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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