File avogadrolibs.changes of Package avogadrolibs
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Mon Jun 9 07:20:08 UTC 2025 - Christophe Marin <christophe@krop.fr>
- Add upstream fix (gh#OpenChemistry/avogadrolibs#2021)
* fix-cmake-dependencies.patch
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Mon May 19 11:19:52 UTC 2025 - Atri Bhattacharya <badshah400@gmail.com>
- Add eigen3-devel to avogadrolibs-devel Requires.
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Mon May 12 06:26:42 UTC 2025 - Atri Bhattacharya <badshah400@gmail.com>
- Update to version 1.00.0:
* Too many changes to list, see
<https://github.com/OpenChemistry/avogadrolibs/releases/tag/1.100.0>
- Add fragments-1.99.0.tar.gz as source, needed for build.
- Switch to Qt6 for build.
- Enable testing during build and run tests as part of %check for
openSUSE > 1550 (gtest too old on 15.6 and older); add necessary
deps cmake(GTest) and cmake(Qt6Test) as BuildRequires.
- Build with system nlohmann_json, pugixml.
- Drop dependence on Molequeue (abandoned, does not build with
Qt6).
- Fix builds for Leap 15.6 after switching to Qt6 (needs gcc-c++
>= 8 for <filesystem> support).
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Thu Mar 20 22:59:18 UTC 2025 - Shawn Dunn <sfalken@opensuse.org>
- Add -DCMAKE_POLICY_VERSION_MINIMUM=3.5 to fix FTFBS with cmake4
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Wed Mar 20 16:45:50 UTC 2024 - Lubos Kocman <lubos.kocman@suse.com>
- Update licenses based on legaldb scan
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Wed Dec 6 10:23:54 UTC 2023 - Atri Bhattacharya <badshah400@gmail.com>
- Update to version 1.98.1:
* Migrated typedefs and changed const to constexpr
(gh#OpenChemistry/avogadrolibs#1395).
* Fix Python module install dir
(gh#OpenChemistry/avogadrolibs#1413).
* Revert validation of filenames
(gh#OpenChemistry/avogadrolibs#1433).
* Parsing orca output would crash when swapping orbitals
(gh#OpenChemistry/avogadrolibs#1422).
* Maint: vtk: Add missing OpenGL link target
(gh#OpenChemistry/avogadrolibs#1412).
- Update molecules and crystals source tarballs to version
1.98.0.
- Drop upstreamed patches:
* Fix_qtplugins_surfaces_linking.patch
* 0001-Avoid-ambigous-definition-of-mmtf-s-is_polymer.patch.
- Minor rebase of not-install-gwavi.patch to apply cleanly.
- Remove executable permissions from scripts not installed to
$PATH and not expected to be directly executed.
- Bump cmake required version to 3.24 as required by upstream.
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Wed Dec 7 03:55:56 UTC 2022 - Stefan Brüns <stefan.bruens@rwth-aachen.de>
- Fix build with mmtf-cpp 1.1.0, add
0001-Avoid-ambigous-definition-of-mmtf-s-is_polymer.patch
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Sun Sep 11 18:39:13 UTC 2022 - Stefan Brüns <stefan.bruens@rwth-aachen.de>
- 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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Tue Oct 19 13:08:05 UTC 2021 - Guillaume GARDET <guillaume.gardet@opensuse.org>
- Workaround for Arm/openGL ES, until overlayaxes fixed upstream
https://github.com/OpenChemistry/avogadrolibs/issues/810
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Thu Oct 14 11:32:05 UTC 2021 - ecsos <ecsos@opensuse.org>
- Update to 1.95.1
* Bug Fixes
- Fix disabled Balls and Sticks rendering on a fresh install (#744)
- Fix for loading settings (#732)
- Add ... to all input generators to indicate opening a dialog (#743)
- Fix reference axes menu item (#705)
- Continue rendering cartoons even if residues aren't found (#736)
- Enable script formats like cclib to ask for bond perception on read (#738)
* Features
- Initial display-only property tables (#711)
- Improve selection tool for layers (#729)
* Maintenance
- Make sure to run tests in avogadrolibs (including some fix for test failures) (#739)
* Translations
- Translations update from Weblate (#721)
- Fix build error for Leap with libmsym >= 0.2.0.
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Mon Aug 30 09:00:55 UTC 2021 - Ferdinand Thiessen <rpm@fthiessen.de>
- Update to version 1.95.0
* Update render options for Wireframe and Ball-and-Sticks
* Use MMTF downloads - more efficient than PDB format
* Add back support for importing crystals
* Add CJSON support for save/load residues and atom colors
* Detect secondary structure from residues / backbones
* Remove dependency on MoleQueue (bundled...)
* Export to SVG
* OpenMM script builder plugin
* Allow manipulate to rotate selected fragments
* Add bestFitPlane on Molecule
* Transparent support for ASE "extended XYZ" files
* Switch Open Babel calls to use CML and non-local numeric format
* Save background color across sessions and set bg alpha for export
* Add support for a JSON list of selected atoms
* Update example Avogadro RPC script
* Fix several crashes with proteins
* Fix crash in CJSON reading file without labels
* Fix bug deleting selected atoms
- Add molecules and crystals data files as source, as downloading
on build time is not possible on OBS
- Drop upstream merged avogadrolibs-spglib-includes.patch
- Split data molecules and crystals data into avogadro2-data package
and seperated plugins into plugins subpackage
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Sat Aug 21 11:32:55 UTC 2021 - Dirk Stoecker <opensuse@dstoecker.de>
- Move non-library stuff into it's own package again
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Wed Aug 18 12:05:15 UTC 2021 - Atri Bhattacharya <badshah400@gmail.com>
- Add avogadrolibs-spglib-includes.patch -- Correct spglib
includes according to the location spglib headers are installed
to on openSUSE, which is directly inside %%_includedir.
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Wed Aug 18 06:36:23 UTC 2021 - Ferdinand Thiessen <rpm@fthiessen.de>
- As Factory switched from Avagadro 1 to 2, make factory bot happy
as patches Fix-build-with-Qt-511.patch, fix-linking-issues.patch,
fix-gcc-version-check.patch, 0002-create-soversion-libs.patch,
and use-system-libjsoncpp.patch from old package are not present
in this package.
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Wed May 26 09:49:41 UTC 2021 - Ferdinand Thiessen <rpm@fthiessen.de>
- Update to version 1.93.1
* Add support for a JSON list of selected atoms
* Add support for only clearing selected atoms
* Fix invalid cmake files
* Fix build with HDF5 >= 1.12.0
* Fix problems with large molecule
* Update translations
- Enable building with MoleQueue, mmtf and libmsym they are already
in Factory and science repository
- Split python into seperate package
- Add not-install-gwavi.patch
- Drop upstream fixed fix_libgwavi_linking.patch
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Wed Feb 12 20:45:21 UTC 2020 - Stefan Brüns <stefan.bruens@rwth-aachen.de>
- initial version of Avogadro 2 libs
- Fix linking when using BUILD_STATIC_PLUGINS=OFF
fix_libgwavi_linking.patch
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Sun Jun 3 18:02:51 UTC 2018 - christophe@krop.fr
- Add Fix-build-with-Qt-511.patch to fix build with Qt 5.11.
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Mon Oct 30 07:17:57 UTC 2017 - fstrba@suse.com
- Remove the dependency on java-1_8_0-openjdk-devel, since Java is
apparently not used during the build at all
- Run spec cleaner
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Sat Mar 11 04:10:59 UTC 2017 - wbauer@tmo.at
- Disable building the GPL-licensed plugins
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Mon Feb 6 12:17:34 UTC 2017 - jengelh@inai.de
- Choose an *unambiguous* SONAME for shared library as per
guidelines
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Tue Nov 29 21:13:09 UTC 2016 - wbauer@tmo.at
- disable molequeue support
- add missing pkgconfig(Qt5Network) BuildRequires
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Mon Nov 28 09:00:40 UTC 2016 - tittiatcoke@gmail.com
- Update to 0.9.0
No Changelog available
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Mon Dec 22 17:36:40 UTC 2014 - alinm.elena@gmail.com
- initial commit
