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apbs
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apbs: init at 3.4.1 (#230644)
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2023-05-23 01:10:16 +02:00 |
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autodock-vina
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treewide: noop: refer to src.name or similar in sourceRoot where appropriate, part 1: trivial cases
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2023-08-03 16:32:03 +00:00 |
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avogadro2
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avogadro2: 1.95.1 -> 1.97.0
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2022-10-04 16:34:10 +02:00 |
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chemtool
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treewide: move NIX_CFLAGS_COMPILE to the env attrset
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2023-02-22 21:23:04 +02:00 |
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cp2k
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cp2k: use mpiCheckPhaseHook
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2023-08-22 23:27:47 +02:00 |
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d-seams
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treewide: Rename libyamlcpp* to yaml-cpp*
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2023-01-31 16:22:54 +01:00 |
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dkh
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element
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treewide: vendorSha256 → vendorHash
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2023-09-13 01:03:44 -06:00 |
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ergoscf
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ergoscf: 3.8 -> 3.8.2
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2023-08-23 15:05:58 +02:00 |
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gwyddion
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treewide: mark packages broken that never built on PLATFORM
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2022-12-13 21:40:12 +01:00 |
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jmol
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jmol: 16.1.33 -> 16.1.35
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2023-08-31 02:32:25 +00:00 |
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marvin
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marvin: 22.13.0 -> 23.4.0
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2023-03-21 07:22:28 +00:00 |
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molden
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molden: unbreak build, make compatible with gcc-10
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2022-05-10 17:01:35 +02:00 |
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mopac
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mopac: init at 22.0.6
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2023-02-06 16:54:14 +01:00 |
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nwchem
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nwchem: use mpiCheckPhaseHook
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2023-08-22 23:27:47 +02:00 |
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octopus
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octopus: 12.2 -> 13.0
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2023-07-06 15:25:28 +02:00 |
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openmolcas
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openmolcas: enable dmrg and nevpt2 support
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2023-08-03 17:34:32 +02:00 |
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pymol
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pymol: remove broken mark for darwin
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2023-04-01 20:41:01 +09:00 |
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quantum-espresso
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siesta
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siesta: fix typos
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2023-05-09 18:02:16 +04:00 |
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wxmacmolplt
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wxmacmolplt: fix typo
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2023-05-12 10:41:17 +02:00 |
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