Package Release Info

avogadro-1.98.1-bp156.1.2

Update Info: Base Release
Available in Package Hub : 15 SP6

platforms

AArch64
ppc64le
s390x
x86-64

subpackages

avogadro
avogadro-lang

Change Logs

* Fri Feb 23 2024 Dominique Leuenberger <dimstar@opensuse.org>
- Remove documentation installed by cmake: we package those files
  using %doc.
- Do not recommend -lang package: the package already has relevant
  supplements in place.
* Wed Dec 06 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 avogadro-i18n source to 1.98.0.
- Requires avogadrolibs >= 1.98.0.
- Bump required cmake version to 3.24 as required by upstream.
* Thu Sep 15 2022 Stefan BrĂ¼ns <stefan.bruens@rwth-aachen.de>
- Update to 1.97.0
  https://github.com/OpenChemistry/avogadroapp/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
* Thu Oct 14 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 Tumbleweed.
* Wed Aug 18 2021 Ferdinand Thiessen <rpm@fthiessen.de>
- Update to 1.95.0
  * New "Layer" system, including custom rendering,
    locking and hiding parts of the molecule
  * Atom and residue labels
  * New protein cartoon / ribbon display
  * Update render options for Wireframe and Ball-and-Sticks
  * Add CJSON support for save/load residues and atom colors
  * New View => Apply Colors menu
  * Apply color schemes for residues
  * Render selected atoms in VdW and licorice modes
  * Save enabled / disabled state of scene / rendering plugins on quit
  * Install all translations
- Add required i18n subpackage as source (OBS does not support
  downloading on build time)
* Thu May 27 2021 Ferdinand Thiessen <rpm@fthiessen.de>
- Update to 1.93.0
  * A lot bug fixes and enhancements
  * Build with QT5
- Drop upstream fixed:
  * avogadro-port-to-eigen3.patch
  * 0005-Link-with-libm.patch
  * 0004-don-t-use-signbit-on-non-float.patch
  * avogadro-1.1.0-avopkg-fix-echo.patch
  * avogadro-boost.patch
  * avogadro-opanbabel.patch
- Icon and desktop file are now provided by upstream, dopped our
  versions
- Drop baselibs.conf, no libraries are installed (they are provided
  by the avogadrolibs package)
Version: 1.2.0-bp151.4.2
* Tue Apr 02 2019 Andreas Schwab <schwab@suse.de>
- Remove 0006-Fix-libmsym-libdir-for-64bit.patch and define
  INSTALL_LIB_DIR and INSTALL_CMAKE_DIR via cmdline instead
* Tue Mar 26 2019 Atri B <badshah400@gmail.com>
- Add avogadro-port-to-eigen3.patch: Pick commits from upstream
  to get avogadro building with eigen3; replace libeigen2-devel
  BuildRequires by eigen3-devel.
- Use cmake macros for build (%%cmake_build) and install
  (%%cmake_install).
- Use autosetup to setup source and apply patches in one go.
- Minor specfile cleanups:
  * Use %%license to package COPYING file.
  * Do away with defattrs for file lists.
Version: 1.2.0-bp150.1.3
* Wed Mar 07 2018 crrodriguez@opensuse.org
- Correct buildrequires so xorg-x11-devel is no longer
  used.
* Sat Feb 03 2018 wbauer@tmo.at
- Force python2 by passing -DPYTHON_EXECUTABLE=%{_bindir}/python2
  to cmake to fix build on Tumbleweed
* Wed Dec 27 2017 kkaempf@suse.com
- 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)
- add 0004-don-t-use-signbit-on-non-float.patch,
  0005-Link-with-libm.patch, 0006-Fix-libmsym-libdir-for-64bit.patch
- fix package group: Productivity/Scientific/Chemistry
* Sat Dec 23 2017 wbauer@tmo.at
- BuildRequire libboost_python-devel instead of boost-devel on
  Tumbleweed to fix build
* Mon Mar 28 2016 dvaleev@suse.com
- Fix buildfailure with openbabel (avogadro-opanbabel.patch)
* Thu Jan 07 2016 idonmez@suse.com
- Add avogadro-boost.patch to fix build failures with boost 1.60.0
* Sat Apr 04 2015 dmueller@suse.com
- add arm-qreal-vs-double.patch
* Tue Mar 24 2015 sfalken@opensuse.org
- Added patch to fix building against cmake >= 3.2, libX11 is no
  longer magically implied. (sf#avogadro/bugs/746)
  + avogadro-cmake-3.2.patch
* Sat Feb 14 2015 Led <ledest@gmail.com>
- fix using 'echo' command in avopkg script
- add patches:
  * avogadro-1.1.0-avopkg-fix-echo.patch
* Thu Dec 18 2014 p.drouand@gmail.com
- Update to version 1.1.1
  * Rudimentary support for retinal display Macs
  * Support for manual adjustment of the view
  * DNA/RNA builder
  * Simple LAMMPS input generator for water
  * PSI4 input generator added
  * Fixed QTAIM to work on Windows
  * Updated gl2ps snapshot
- Remove fixed patches
  * avogadro-1.1.0-no-return-in-nonvoid-function.patch
  * MopacAuxReaderFix.patch
  * shlib-pic-flag.patch
- Use %cmake macro
* Thu Dec 18 2014 p.drouand@gmail.com
- Update to version 1.1.1
  * Rudimentary support for retinal display Macs
  * Support for manual adjustment of the view
  * DNA/RNA builder
  * Simple LAMMPS input generator for water
  * PSI4 input generator added
  * Fixed QTAIM to work on Windows
  * Updated gl2ps snapshot
- Remove fixed patches
  * avogadro-1.1.0-no-return-in-nonvoid-function.patch
  * MopacAuxReaderFix.patch
  * shlib-pic-flag.patch
- Use %cmake macro
* Sun Aug 11 2013 schwab@suse.de
- Compile with %{optflags}
- Use RelWithDebInfo build type not to strip binaries
- shlib-pic-flag.patch: Always use PIC in shlib objects
* Tue Feb 05 2013 stecue@gmail.com
- added MopacAuxReaderFix.patch to avoid crash when loading aux.
- fixed build on SLES
- split off python package
  (also use sitearch for arch-dependent files)
* Sun Feb 03 2013 lars@linux-schulserver.de
- added avogadro-1.1.0-no-return-in-nonvoid-function.patch
* Sun Oct 07 2012 lars@linux-schulserver.de
- update to 1.1.0:
  + Fix crash with dipole moment after optimization (PR#3521044)
  + Add test files for QTAIM analysis, including diborane(B2H6),
    C4H4, and HCO2. These files will be used for a tutorial
  + Fix residue and atom code assignment
  + be conservative about changing elements when copying atoms
    for the same reason
- removed avogadro-boost148.patch and avogadro-nostrip.patch
* Fri Oct 05 2012 coolo@suse.com
- glew no longer requires glu, so buildrequire it explicitly
* Mon Sep 24 2012 schwab@linux-m68k.org
- Use %{optflags} and don't strip binaries
* Tue Apr 03 2012 idonmez@suse.com
- Fix compile with boost 1.48
* Wed Feb 15 2012 lars@linux-schulserver.de
- fix Copyright header in specfile and license (spdx format)
* Tue Nov 29 2011 ro@suse.de
- use _lib macro to determine lib suffix