nixpkgs/pkgs/applications/science/chemistry
2024-01-28 21:17:02 +00:00
..
apbs apbs: fix build with clang 16 2023-11-01 00:34:30 +01:00
autodock-vina treewide: noop: refer to src.name or similar in sourceRoot where appropriate, part 1: trivial cases 2023-08-03 16:32:03 +00:00
avogadro2 avogadro2: 1.97.0 -> 1.98.1 2023-12-18 14:21:12 +01:00
chemtool treewide: move NIX_CFLAGS_COMPILE to the env attrset 2023-02-22 21:23:04 +02:00
cp2k cp2k: 2023.2 -> 2024.1 2024-01-09 16:44:06 +01:00
d-seams treewide: Rename libyamlcpp* to yaml-cpp* 2023-01-31 16:22:54 +01:00
dkh
element treewide: vendorSha256 → vendorHash 2023-09-13 01:03:44 -06:00
ergoscf ergoscf: 3.8 -> 3.8.2 2023-08-23 15:05:58 +02:00
gwyddion gwyddion: 2.64 -> 2.65 2024-01-05 05:30:02 +00:00
jmol jmol: 16.1.49 -> 16.1.51 2024-01-28 21:17:02 +00:00
marvin marvin: pin openjdk17 2024-01-25 08:59:41 +01:00
molden molden: disable parallel building 2024-01-19 17:17:06 +01:00
mopac mopac: 22.0.6 -> 22.1.0 2023-09-27 22:54:32 +02:00
nwchem nwchem: 7.2.1 -> 7.2.2 2023-11-05 14:08:05 +01:00
octopus octopus: fixup build by adding which 2024-01-25 09:12:08 +01:00
openmolcas openmolcas: fix pyparsing >= 3.11 compatibility 2024-01-22 15:09:57 +01:00
pymol python311Packages.pyqt5-sip: rename from pyqt5_sip 2024-01-10 22:49:05 +01:00
quantum-espresso quantum-espresso: 6.6 -> 7.2 2023-12-04 17:08:07 +01:00
siesta siesta: fix typos 2023-05-09 18:02:16 +04:00
wxmacmolplt wxmacmolplt: 7.7.2 -> 7.7.3 2024-01-04 05:15:19 +00:00