about summary refs log tree commit diff
path: root/pkgs/applications/science/chemistry
AgeCommit message (Expand)AuthorFilesLines
2019-06-17jmol: 14.29.42 -> 14.29.46 (#63277)R. RyanTM1-2/+2
2019-06-16treewide: remove unused variables (#63177)volth1-1/+1
2019-06-11octopus: 8.4 -> 9.0Markus Kowalewski1-2/+2
2019-06-04quantum-espresso: 6.4 -> 6.4.1 (#62556)R. RyanTM1-2/+2
2019-06-01jmol: 14.29.40 -> 14.29.42R. RyanTM1-2/+2
2019-05-17molden: 5.9.5 -> 6.1Markus Kowalewski1-2/+2
2019-05-01jmol: 14.29.36 -> 14.29.40R. RyanTM1-2/+2
2019-04-15jmol: 14.29.32 -> 14.29.36 (#59546)R. RyanTM1-2/+2
2019-04-03Merge pull request #58860 from r-ryantm/auto-update/quantum-espressomarkuskowa1-8/+2
2019-04-03quantum-espresso: remove outdated makefile fixMarkus Kowalewski1-6/+0
2019-04-02quantum-espresso: 6.3 -> 6.4R. RyanTM1-3/+3
2019-04-01jmol: 14.29.31 -> 14.29.32 (#58698)R. RyanTM1-2/+2
2019-03-29Merge pull request #58494 from markuskowa/upd-octopusSilvan Mosberger1-2/+2
2019-03-28octopus: 8.3 -> 8.4Markus Kowalewski1-2/+2
2019-03-28molden: 5.9.3 -> 5.9.5Markus Kowalewski1-2/+2
2019-02-06Merge pull request #55299 from r-ryantm/auto-update/jmolTimo Kaufmann1-4/+3
2019-02-06jmol: remove redundant name attributeMarkus Kowalewski1-2/+1
2019-02-05jmol: 14.29.29 -> 14.29.31R. RyanTM1-2/+2
2019-02-05molden: 5.8.2 -> 5.9.3 (#55044)markuskowa1-2/+2
2019-01-15marvin: init at 19.1.0Brenton Horne4-0/+78
2019-01-04avogadro: fix libX11 underlinkingPiotr Bogdan1-0/+7
2018-12-16jmol: 14.29.28 -> 14.29.29 (#52275)R. RyanTM1-2/+2
2018-12-14octopus: 8.2 -> 8.3R. RyanTM1-2/+2
2018-11-24Treewide: use https for SourceForgec0bw3b1-1/+1
2018-11-09jmol: 14.29.26 -> 14.29.28R. RyanTM1-2/+2
2018-10-15jmol: 14.29.22 -> 14.29.26R. RyanTM1-2/+2
2018-09-27Merge pull request #47043 from r-ryantm/auto-update/jmolTimo Kaufmann1-2/+2
2018-09-27openmolcas: 20180529 -> 18.09 (#47410)markuskowa1-3/+3
2018-09-20jmol: 14.29.19 -> 14.29.22R. RyanTM1-2/+2
2018-09-14siesta: init at 4.0.2Chris Ostrouchov1-0/+69
2018-09-14quantum-espresso: init at 6.3Chris Ostrouchov1-0/+49
2018-09-06jmol: 14.29.17 -> 14.29.19R. RyanTM1-2/+2
2018-08-19Merge pull request #45303 from markuskowa/molden-upJörg Thalheim2-2/+33
2018-08-19molden: patch to deactivate extension installer scriptMarkus Kowalewski2-0/+31
2018-08-18msgpack: rename from libmsgpackOrivej Desh1-2/+2
2018-08-18molden: 5.7 -> 5.8.2Markus Kowalewski1-2/+2
2018-08-17Merge branch 'staging-next'Vladimír Čunát1-8/+8
2018-08-16octopus: 8.1 -> 8.2R. RyanTM1-2/+2
2018-08-09Merge master into stagingFrederik Rietdijk1-2/+2
2018-08-07gwyddion, ripser: fix derivation name (#44577)symphorien1-2/+2
2018-08-03treewide: Make more complicated configureFlags listsJohn Ericson1-8/+8
2018-08-02openmolcas: init at 20180529Markus Kowalewski1-0/+72
2018-07-14octopus: 7.2 -> 8.1 (libxc 3.0.1 -> 4.2.3) (#43484)markuskowa1-4/+6
2018-07-12jmol: 14.29.12 -> 14.29.17 (#43429)Timo Kaufmann1-5/+6
2018-05-28treewide: fix derivation namesRyan Mulligan1-1/+1
2018-04-25jmol: made it runnableKatona László1-9/+18
2018-04-25pymol: 1.8.4 -> 2.1.0Katona László1-6/+6
2018-04-22Merge pull request #39332 from markuskowa/octopus-upJoachim F1-2/+2
2018-04-22octopus: 7.2 -> 7.3Markus Kowalewski1-2/+2
2018-04-21jmol: init at 14.29.12Timo Kaufmann1-0/+44
generated by cgit-pink 1.4.1 (git 2.36.1) at 2024-08-03 05:30:10 +0000