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path: root/gnu/packages/chemistry.scm
AgeCommit message (Expand)Author
2024-02-13gnu: rdkit: Update to 2023.09.4.David Elsing
2024-02-13gnu: freesasa: Fix memerr tests.David Elsing
2024-02-13gnu: avalon-toolkit: Update to 2.0.5a.David Elsing
2024-02-13gnu: yaehmop: Update to 2023.03.1.David Elsing
2024-02-13gnu: coordgenlibs: Update to 3.0.2.David Elsing
2024-02-13gnu: maeparser: Update to 1.3.1.David Elsing
2024-02-13gnu: gemmi: Update to 0.6.4.David Elsing
2024-01-09gnu: msgpack: Deprecate with msgpack-c.Maxim Cournoyer
2023-08-21gnu: python-pymol: Remove msgpack from native-inputs.Maxim Cournoyer
2023-08-21gnu: avogadrolibs: Remove msgpack from native-inputs.Maxim Cournoyer
2023-08-21gnu: mmtf-cpp: Update to 1.1.0.Maxim Cournoyer
2023-07-26gnu: python-pymol: Fix launch script.David Elsing
2023-07-18gnu: Rationalize texlive-updmap.cfg and texlive-tiny inputs.Nicolas Goaziou
2023-07-18gnu: yaehmop: Fix build due to missing TeX Live scripts.Nicolas Goaziou
2023-07-18gnu: texlive-fonts-ec -> texlive-ec.Nicolas Goaziou
2023-07-18gnu: texlive-latex-geometry -> texlive-geometry.Nicolas Goaziou
2023-03-02Merge remote-tracking branch 'savannah/master' into core-updatesChristopher Baines
2023-02-19gnu: Use HTTPS package home pages wherever possible.Tobias Geerinckx-Rice
2023-02-16gnu: Remove unneeded module imports.Efraim Flashner
2023-01-30gnu: texlive-graphics: Use over deprecated texlive-latex-graphics.Efraim Flashner
2023-01-12gnu: gromacs: Mark as tunable.Ludovic Courtès
2023-01-10gnu: gromacs: Remove input labels and use gexps.Ludovic Courtès
2023-01-10gnu: gromacs: Update to 2022.4.Ludovic Courtès
2022-10-27gnu: python-setuptools: Move to python-build.Lars-Dominik Braun
2022-10-15gnu: Add rdkit.David Elsing
2022-10-15gnu: Add ringdecomposerlib.David Elsing
2022-10-15gnu: Add avalon-toolkit.David Elsing
2022-10-15gnu: Add yaehmop.David Elsing
2022-10-15gnu: Add coordgenlibs.David Elsing
2022-10-15gnu: Add maeparser.David Elsing
2022-10-15gnu: Add freesasa.David Elsing
2022-10-15gnu: Add gemmi.David Elsing
2022-10-15gnu: Add sajson-for-gemmi.David Elsing
2022-09-15gnu: catch-framework2: Rename variable to catch2.Maxim Cournoyer
2022-05-31gnu: Remove python2-numpy.Maxim Cournoyer
2022-05-31gnu: Remove nmoldyn.Maxim Cournoyer
2022-05-31gnu: Remove domainfinder.Maxim Cournoyer
2021-12-13gnu: Simplify package inputs.Ludovic Courtès
2021-10-12Merge remote-tracking branch 'origin/master' into core-updates-frozen.Mathieu Othacehe
2021-09-20gnu: Add python-pymol.Ricardo Wurmus
2021-07-24gnu: Use 'search-input-file' when looking for executables.Ludovic Courtès
2021-06-14gnu: Rename qtbase to qtbase-5.Maxim Cournoyer
2021-02-01gnu: openbabel: Update to 3.1.1.Kei Kebreau
2021-02-01gnu: inchi: Update to 1.06.Kei Kebreau
2021-01-29gnu: Remove avogadro.Leo Famulari
2021-01-25gnu: Add avogadro2.Kei Kebreau
2021-01-25gnu: Add avogadrolibs.Kei Kebreau
2021-01-25gnu: Add libmsym.Kei Kebreau
2021-01-25gnu: Add molequeue.Kei Kebreau
2021-01-25gnu: Add mmtf-cpp.Kei Kebreau
generated by cgit-pink 1.4.1 (git 2.36.1) at 2024-11-29 22:32:08 +0000