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sci-chemistry
Commit message (
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Author
Age
Files
Lines
*
sci-chemistry/chemex: drop 2024.05.2-r1
Pacho Ramos
2024-11-08
2
-45
/
+0
*
sci-chemistry/chemex: add 2024.09.25
Pacho Ramos
2024-11-08
2
-0
/
+45
*
sci-chemistry/psi: update EAPI 7 -> 8
David Seifert
2024-11-03
2
-3
/
+25
*
sci-chemistry/gromacs: Re-enable man-pages
Alexey Shvetsov
2024-10-25
1
-0
/
+2
*
sci-chemistry/gromacs: drop upstreamed patch
Alexey Shvetsov
2024-10-25
2
-42
/
+0
*
sci-chemistry/gromacs: Sync patch with upstreamed one
Alexey Shvetsov
2024-10-20
2
-2
/
+3
*
sci-chemistry/gromacs: Correct depend when openmp is enabled
Alexey Shvetsov
2024-10-19
8
-0
/
+32
*
sci-chemistry/gromacs: Update live version
Alexey Shvetsov
2024-10-19
3
-3
/
+55
*
sci-chemistry/mopac7: treeclean
Arthur Zamarin
2024-10-18
4
-113
/
+0
*
sci-chemistry/gromacs: drop 2024.1, 2024.2
Alexey Shvetsov
2024-10-18
3
-676
/
+0
*
sci-chemistry/gromacs: add 2024.3
Alexey Shvetsov
2024-10-18
2
-0
/
+338
*
sci-chemistry/gromacs: drop 2023.4
Alexey Shvetsov
2024-10-18
2
-338
/
+0
*
sci-chemistry/gromacs: add 2023.5
Alexey Shvetsov
2024-10-18
2
-0
/
+338
*
sci-chemistry/molmol: drop 2k_p2-r8
Pacho Ramos
2024-10-17
1
-102
/
+0
*
sci-chemistry/molmol: Really disable parallel build
Pacho Ramos
2024-10-17
1
-1
/
+7
*
sci-chemistry/dssp: add 4.4.10
Pacho Ramos
2024-10-17
2
-0
/
+56
*
sci-chemistry/dssp: drop 4.4.4.1
Pacho Ramos
2024-10-17
2
-55
/
+0
*
sci-chemistry/dssp: add 4.4.8
Pacho Ramos
2024-10-17
2
-0
/
+56
*
sci-chemistry/pymol: Multiple bugfixes
Pacho Ramos
2024-09-28
7
-0
/
+485
*
sci-chemistry/chemical-mime-data: drop 0.1.94-r4 and it's patches
Filip Kobierski
2024-09-25
7
-198
/
+0
*
sci-chemistry/GromacsWrapper: remove empty variables
Filip Kobierski
2024-09-25
1
-3
/
+1
*
sci-chemistry/GromacsWrapper: drop 0.8.4
Filip Kobierski
2024-09-25
2
-41
/
+0
*
sci-chemistry/chemical-mime-data: fix pkgcheck issues
Filip Kobierski
2024-09-25
1
-4
/
+2
*
sci-chemistry/mopac7: mark as LTO-unsafe
Eli Schwartz
2024-09-09
1
-1
/
+7
*
sci-chemistry/pymol: mark as LTO-unsafe
Eli Schwartz
2024-09-05
1
-0
/
+5
*
sci-chemistry/pymol: drop a bunch of dependencies to runtime-only
Eli Schwartz
2024-09-05
1
-6
/
+7
*
sci-chemistry/tinker: mark as LTO-unsafe
Eli Schwartz
2024-08-05
1
-1
/
+6
*
sci-chemistry/votca: sync live ebuild
Pacho Ramos
2024-07-31
1
-3
/
+3
*
sci-chemistry/votca: support py3.12
Pacho Ramos
2024-07-31
1
-2
/
+2
*
sci-chemistry/openbabel: sync live ebuild
Pacho Ramos
2024-07-30
1
-4
/
+8
*
sci-chemistry/openbabel: enable py3.12
Pacho Ramos
2024-07-30
1
-1
/
+1
*
sci-chemistry/propka: add 3.5.1
Pacho Ramos
2024-07-30
2
-0
/
+29
*
sci-chemistry/procheck: treeclean
Arthur Zamarin
2024-07-19
5
-182
/
+0
*
sci-chemistry/aqua: treeclean
Arthur Zamarin
2024-07-19
4
-191
/
+0
*
sci-chemistry/xyza2pipe: treeclean
Arthur Zamarin
2024-07-19
4
-211
/
+0
*
sci-chemistry/namd: treeclean
Arthur Zamarin
2024-07-19
5
-271
/
+0
*
sci-chemistry/autodock_vina: Stabilize 1.2.5 amd64, #935909
Arthur Zamarin
2024-07-13
1
-1
/
+1
*
sci-chemistry/autodock_vina: fix build w/ boost-1.85
Sam James
2024-07-12
2
-0
/
+22
*
sci-chemistry/vmd: Fix compat with numpy-2 and don't mess with linking
Pacho Ramos
2024-07-11
1
-0
/
+263
*
sci-chemistry/molmol: Stabilize 2k_p2-r9 amd64, #935856
Jakov Smolić
2024-07-11
1
-1
/
+1
*
sci-chemistry/wxmacmolplt: drop 7.5-r1
Pacho Ramos
2024-07-05
3
-60
/
+0
*
sci-chemistry/xds-bin: drop 20170930
Arthur Zamarin
2024-07-05
2
-49
/
+1
*
sci-chemistry/xds-bin: add 20240831
Markus Meier
2024-07-05
2
-1
/
+59
*
sci-chemistry/openbabel: drop 3.1.1_p20210225
Andreas Sturmlechner
2024-06-29
1
-280
/
+0
*
*/*: delete some utterly bogus remote-ids
Eli Schwartz
2024-06-28
1
-3
/
+0
*
sci-chemistry/chemex: fix mysterious overdependency on tomli
Eli Schwartz
2024-06-27
2
-2
/
+0
*
sci-chemistry/gromacs: Add ~riscv keyword
Alexey Shvetsov
2024-06-23
4
-4
/
+4
*
sci-chemistry/threeV: EAPI 6 -> 8
Arthur Zamarin
2024-06-21
1
-12
/
+5
*
sci-chemistry/chemex: drop 2022.3.6, 2024.02.16
Pacho Ramos
2024-06-16
3
-90
/
+0
*
sci-chemistry/chemex: add 2024.05.3
Pacho Ramos
2024-06-16
2
-0
/
+46
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