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Commit message (
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Author
Age
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jmol: 14.32.30 -> 14.32.33
R. Ryantm
2022-03-13
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jmol: 14.32.28 -> 14.32.30
R. Ryantm
2022-03-08
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marvin: 22.3.0 -> 22.7.0
R. Ryantm
2022-03-06
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jmol: 14.32.24 -> 14.32.28
R. Ryantm
2022-03-03
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treewide: fix versions starting with 'v'
Felix Buehler
2022-02-28
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treewide: switch all desktop file generators to new API
K900
2022-02-25
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jmol: 14.32.21 -> 14.32.24
R. Ryantm
2022-02-24
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Merge pull request #159540 from r-ryantm/auto-update/marvin
Mario Rodas
2022-02-19
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marvin: 21.20.0 -> 22.3.0
R. Ryantm
2022-02-12
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Merge pull request #156420 from azuwis/transfig
Sandro
2022-02-16
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chemtool: Set platforms to linux
Zhong Jianxin
2022-02-15
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jmol: 14.32.6 -> 14.32.21
R. Ryantm
2022-02-15
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molden: fix download URL
Markus Kowalewski
2022-01-20
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cp2k: 8.2.0 -> 9.1.0
Phillip Seeber
2022-01-10
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jmol: 14.32.2 -> 14.32.6
R. Ryantm
2021-12-30
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marvin: 21.18.0 -> 21.20.0
R. Ryantm
2021-12-25
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Merge pull request #150031 from r-ryantm/auto-update/jmol
Ryan Mulligan
2021-12-11
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jmol: 14.31.49 -> 14.32.2
R. Ryantm
2021-12-10
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Merge pull request #150121 from markuskowa/fix-cp2k
Jörg Thalheim
2021-12-11
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cp2k: make elpa optional
Markus Kowalewski
2021-12-10
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Merge pull request #150124 from r-ryantm/auto-update/gwyddion
Jörg Thalheim
2021-12-11
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gwyddion: 2.59 -> 2.60
R. Ryantm
2021-12-10
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marvin: 21.9.0 -> 21.18.0
R. Ryantm
2021-12-09
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cp2k: build with elpa
Markus Kowalewski
2021-12-02
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octopus: 11.2 -> 11.3
Markus Kowalewski
2021-11-28
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Merge pull request #145614 from sheepforce/openmolcas
markuskowa
2021-11-12
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openmolcas: 20.06 -> 20.10
Phillip Seeber
2021-11-12
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octopus: 10.5 -> 11.2
Phillip Seeber
2021-11-12
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pkgs/applications: rename name to pname&version part 2
Felix Buehler
2021-11-07
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Merge pull request #140975 from sheepforce/avogadro2-updates
markuskowa
2021-10-08
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avogadro2: initialise a translation repo
Phillip Seeber
2021-10-08
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avogadro2: 1.94.0 -> 1.95.1
Phillip Seeber
2021-10-08
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siesta: 4.1-b3 -> 4.1.5
Bruno Bzeznik
2021-10-05
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Merge staging-next into staging
github-actions[bot]
2021-09-17
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Merge pull request #138061 from Stunkymonkey/switch-fetchFromGitLab
Robert Scott
2021-09-16
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quantum-espresso: switch to fetchFromGitLab
Felix Buehler
2021-09-15
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Merge staging-next into staging
github-actions[bot]
2021-09-16
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octopus: add CPU optimization flags
Markus Kowalewski
2021-09-16
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siesta: move gfortran to nativeBuildInputs
Markus Kowalewski
2021-09-03
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quantum-espresso: move gfortran to nativeBuildInputs
Markus Kowalewski
2021-09-03
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openmolcas: move gfortran to nativeBuildInputs
Markus Kowalewski
2021-09-03
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pymol: 2.3.0 -> 2.5.0
Vladimir Serov
2021-08-19
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jmol: 14.31.46 -> 14.31.49
R. RyanTM
2021-08-09
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Merge pull request #130359 from sheepforce/avogadro2
Sandro
2021-08-08
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avogadro2: init at 1.94.0
Phillip Seeber
2021-07-27
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openmolcas: 21.02 -> 21.06
Markus Kowalewski
2021-08-05
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ergoscf: init at 3.8
Markus Kowalewski
2021-08-04
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Merge remote-tracking branch 'upstream/master' into staging-next
Frederik Rietdijk
2021-07-26
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jmol: 14.31.44 -> 14.31.46
R. RyanTM
2021-07-24
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Merge staging-next into staging
github-actions[bot]
2021-07-12
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