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sci-chemistry
Commit message (
Expand
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Author
Age
Files
Lines
*
sci-chemistry/gromacs: Update deps for man/help build
Alexey Shvetsov
9 days
3
-3
/
+30
*
Move {sys-devel → llvm-core}/clang
Michał Górny
10 days
8
-8
/
+8
*
Move {sys-devel → llvm-core}/clang-runtime
Michał Górny
10 days
8
-8
/
+8
*
sci-chemistry/gromacs: Fix man build with upstream patch
Alexey Shvetsov
11 days
2
-4
/
+48
*
sci-chemistry/pymol: remove unused patch
Michael Mair-Keimberger
2024-12-07
1
-15
/
+0
*
sci-chemistry/molden: Remove last-rited pkg
Michał Górny
2024-12-06
4
-173
/
+0
*
sci-chemistry/avogadro2: drop 1.95.1
Andreas Sturmlechner
2024-11-25
2
-84
/
+0
*
sci-chemistry/gromacs: hdf5 support not ready for 2025
Alexey Shvetsov
2024-11-25
2
-6
/
+4
*
sci-chemistry/gromacs: drop 2020.7-r1, 2021.7-r1, 2022.6
Alexey Shvetsov
2024-11-23
9
-1469
/
+0
*
sci-chemistry/pymol: drop 3.0.0
Andreas Sturmlechner
2024-11-23
2
-116
/
+0
*
sci-chemistry/gromacs: Stabilize 2024.3 amd64, #944251
Michał Górny
2024-11-23
1
-1
/
+1
*
sci-chemistry/gromacs: Stabilize 2023.5 amd64, #944251
Michał Górny
2024-11-23
1
-1
/
+1
*
Rename dev-python/{PyQt5 → pyqt5}
Michał Górny
2024-11-23
2
-4
/
+4
*
Rename dev-python/{GridDataFormats → griddataformats}
Michał Górny
2024-11-22
1
-1
/
+1
*
sci-chemistry/gromacs: disable man pages build
Alexey Shvetsov
2024-11-22
1
-3
/
+3
*
sci-chemistry/gromacs: Stabilize 2024.3 arm64, #944251
Arthur Zamarin
2024-11-21
1
-1
/
+1
*
sci-chemistry/gromacs: Stabilize 2023.5 arm64, #944251
Arthur Zamarin
2024-11-21
1
-1
/
+1
*
sci-chemistry/gromacs: also drop x86 keyword on prefix for 2024+
Alexey Shvetsov
2024-11-21
6
-6
/
+6
*
sci-chemistry/gromacs: drop x86-32 since upstream already did it
Alexey Shvetsov
2024-11-21
3
-3
/
+3
*
sci-chemistry/gromacs: Fix build with gcc-15
Alexey Shvetsov
2024-11-21
4
-0
/
+42
*
sci-chemistry/gromacs: add 2024.4
Alexey Shvetsov
2024-11-21
2
-0
/
+342
*
sci-chemistry/gromacs: drop 2024
Alexey Shvetsov
2024-11-21
2
-338
/
+0
*
sci-chemistry/gromacs: add first beta for 2025 release
Alexey Shvetsov
2024-11-21
4
-2
/
+710
*
*/*: rename account andrewammerlaan -> nowa
Nowa Ammerlaan
2024-11-12
1
-1
/
+1
*
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
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