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2021-04-29jmol: 14.31.35 -> 14.31.36R. RyanTM1-2/+2
2021-03-25marvin: 21.2.0 -> 21.3.0R. RyanTM1-2/+2
2021-03-23jmol: 14.31.34 -> 14.31.35R. RyanTM1-2/+2
2021-03-21Merge pull request #111224 from r-ryantm/auto-update/gwyddionSandro1-2/+2
2021-03-14jmol: 14.31.32 -> 14.31.34R. RyanTM1-2/+2
2021-03-08jmol: 14.31.24 -> 14.31.32R. RyanTM1-2/+2
2021-03-03quantum-espresso: enable on darwinLio李歐1-1/+1
2021-02-26jmol: 14.31.18 -> 14.31.24R. RyanTM1-2/+2
2021-02-10marvin: 21.1.0 -> 21.2.0R. RyanTM1-2/+2
2021-02-03chemtool: init at 1.6.14AndersonTorres1-0/+50
2021-02-01openmolcas: fix licenseMarkus Kowalewski1-1/+1
2021-01-31molden: fix outdated URLsMarkus Kowalewski1-3/+3
2021-01-30marvin: 20.21.0 -> 21.1.0R. RyanTM1-2/+2
2021-01-29gwyddion: 2.56 -> 2.57R. RyanTM1-2/+2
2021-01-25treewide: remove stdenv where not neededPavol Rusnak2-2/+2
2021-01-23mpi: use mpi attribute consistently as the default MPI implementationsMarkus Kowalewski3-9/+11
2021-01-20Merge pull request #110086 from r-ryantm/auto-update/marvinRyan Mulligan1-2/+2
2021-01-21treewide: editorconfig fixeszowoq1-2/+1
2021-01-20marvin: 20.20.0 -> 20.21.0R. RyanTM1-2/+2
2021-01-19treewide: pkgs.pkgconfig -> pkgs.pkg-config, move pkgconfig to alias.nixJonathan Ringer1-2/+2
2021-01-18avogadro: update maintainersSandro Jäckel1-3/+3
2021-01-16treewide: stdenv.lib -> libBen Siraphob5-14/+14
2021-01-11treewide: with stdenv.lib; in meta -> with lib;Profpatsch7-12/+12
2021-01-10Merge master into staging-nextgithub-actions[bot]1-4/+16
2021-01-09octopus: 10.0 -> 10.3Markus Kowalewski1-3/+15
2021-01-09octopus: update licensesMarkus Kowalewski1-1/+1
2021-01-04Merge staging-next into stagingFrederik Rietdijk1-2/+2
2021-01-04Merge pull request #107223 from markuskowa/upd-qemarkuskowa1-2/+2
2021-01-03treewide: remove enableParallelBuilding = true if using cmakeBen Siraphob2-3/+0
2020-12-26openmolcas: set platform to x86-64-linuxMarkus Kowalewski1-1/+1
2020-12-26openmolcas: fix fallout from #83888Markus Kowalewski1-3/+1
2020-12-19quantum-espresso: 6.5 -> 6.6Markus Kowalewski1-2/+2
2020-11-30openmolcas: fix hashMarkus Kowalewski1-1/+1
2020-11-28jmol: 14.31.17 -> 14.31.18R. RyanTM1-2/+2
2020-11-19Merge pull request #104083 from timokau/sage-maintainers-teamTimo Kaufmann1-1/+1
2020-11-18marvin: 20.19.0 -> 20.20.0R. RyanTM1-2/+2
2020-11-18maintainers: create sage teamTimo Kaufmann1-1/+1
2020-11-13jmol: 14.31.14 -> 14.31.17R. RyanTM1-2/+2
2020-11-03Merge pull request #102582 from r-ryantm/auto-update/marvinRyan Mulligan1-2/+2
2020-11-03marvin: 20.17.0 -> 20.19.0R. RyanTM1-2/+2
2020-11-02jmol: 14.31.3 -> 14.31.14R. RyanTM1-2/+2
2020-10-19openmolcas: 19.11 -> 20.10Markus Kowalewski2-20/+11
2020-10-19openmolcas: fix build w.r.t. openblasMarkus Kowalewski2-2/+18
2020-09-23jmol: 14.31.2 -> 14.31.3R. RyanTM1-2/+2
2020-08-26marvin: 20.16.0 -> 20.17.0R. RyanTM1-2/+2
2020-08-15d-seams: init at 1.0.1Rohit Goswami1-0/+34
2020-08-09Merge pull request #94779 from r-ryantm/auto-update/marvinRyan Mulligan1-2/+2
2020-08-07octopus: 9.2 -> 10.0Markus Kowalewski1-2/+2
2020-08-06marvin: 20.15.0 -> 20.16.0R. RyanTM1-2/+2
2020-07-09Merge pull request #92796 from r-ryantm/auto-update/jmolTimo Kaufmann1-2/+2
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