Avogadro
An advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible rendering and a powerful plugin architecture.
- Devel package for openSUSE:Factory
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Source Files
Filename | Size | Changed |
---|---|---|
0004-don-t-use-signbit-on-non-float.patch | 0000001267 1.24 KB | |
0005-Link-with-libm.patch | 0000001553 1.52 KB | |
0006-Fix-libmsym-libdir-for-64bit.patch | 0000001570 1.53 KB | |
avogadro-1.1.0-avopkg-fix-echo.patch | 0000001143 1.12 KB | |
avogadro-1.2.0.tar.gz | 0016779635 16 MB | |
avogadro-boost.patch | 0000002708 2.64 KB | |
avogadro-opanbabel.patch | 0000000599 599 Bytes | |
avogadro.changes | 0000010901 10.6 KB | |
avogadro.png | 0000049428 48.3 KB | |
avogadro.spec | 0000006677 6.52 KB | |
baselibs.conf | 0000000111 111 Bytes | |
wget-log | 0000002610 2.55 KB |
Revision 7 (latest revision is 23)
Klaus Kämpf (kwk)
accepted
request 560077
from
Klaus Kämpf (kwk)
(revision 7)
- Update to 1.2.0 * Support for the ORCA quantum chemistry package, thanks to Dagmar Lenk, including input generation and output parsing * Improved support for MO calculations, including orbitals with F, G, H, and I angular momentum, thanks to Dagmar Lenk and Albert DeFusco * Support for exporting VRML models of atoms, bonds, surfaces, and orbitals (e.g. for 3D printing), thanks to Ethan Pavolik * Support for perceiving molecular symmetry on Mac and Linux using the libmsym library1 (i.e., Properties -> Symmetry), thanks to Marcus Johansson * Updated links to the new Avogadro website3, manual4, and discussion forum * Fixed support for compiling with the Eigen3 library up to version 3.2.8 * Improved support for space groups through spglib1 * Updated translations1, now including over 25 languages in addition to English * Fixed a bug downloading from the Protein Data Bank * Fixed a bug fetching molecules from the network, including the "chemical by name" * Fixed a bug when naming molecules from the NIH chemical resolver website - drop avogadro-cmake-3.2.patch, arm-qreal-vs-double.patch (upstream) - fix package group: Productivity/Scientific/Chemistry
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