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path: root/sci-chemistry/gromacs/gromacs-2022.9999.ebuild
Commit message (Expand)AuthorAgeFilesLines
* sci-chemistry/gromacs: drop 2022.9999Alexey Shvetsov2024-02-291-333/+0
* Move {app-doc → app-text}/doxygenMichał Górny2024-01-121-2/+2
* sci-chemistry/gromacs: enable py3.12Alexey Shvetsov2023-11-011-1/+1
* sci-chemistry/gromacs: add quotes for ${HOME}Alexey Shvetsov2023-11-011-2/+2
* sci-chemistry/gromacs: disable py3.9Alexey Shvetsov2023-11-011-1/+1
* sci-chemistry/gromacs: Fix urlsAlexey Shvetsov2023-11-011-3/+3
* sci-chemistry/gromacs: Needs to be rebuilt with cuda subslot changesPacho Ramos2023-07-091-1/+1
* sci-chemistry/gromacs: Revert changes related to wcharAlexey Shvetsov2023-02-021-1/+1
* */*: remove py3.8 from PYTHON_COMPATDavid Seifert2023-01-141-1/+1
* */*: make mycmakeargs localDavid Seifert2023-01-031-2/+2
* sci-chemistry/gromacs: fix muParser depChristoph Junghans2022-12-241-1/+1
* sci-chemistry/gromacs: Refuse to build with double + opencl enabledAlexey Shvetsov2022-12-211-0/+1
* sci-chemistry/gromacs: remove mkl-10 hackAlexey Shvetsov2022-12-211-5/+0
* sci-chemistry/gromacs: Make all uris httpsAlexey Shvetsov2022-12-201-6/+22
* sci-chemistry/gromacs: Add 2022.4 and fix pep517Alexey Shvetsov2022-12-201-1/+2
* sci-chemistry/gromacs: arm was dropped upstream since 2022.xAlexey Shvetsov2022-07-041-1/+2
* sci-chemistry/gromacs: enable py3.11Alexey Shvetsov2022-07-041-1/+1
* sci-chemistry/gromacs: [QA] tc-has-openmp → tc-check-openmpDavid Seifert2022-05-141-3/+2
* sci-chemistry/gromacs: Fix gromacs citatonAlexey Shvetsov2022-02-161-3/+2
* sci-chemistry/gromacs: there no mdrun_only builds with gromacs 2022Alexey Shvetsov2022-02-081-32/+4
* sci-chemistry/gromacs: needs mpi[cxx]Sam James2021-11-041-1/+1
* sci-chemistry/gromacs: Fix depsAlexey Shvetsov2021-11-041-1/+1
* sci-chemistry/gromacs: Unbundle muParserAlexey Shvetsov2021-11-041-10/+9
* sci-chemistry/gromacs: Add 2022_beta1Alexey Shvetsov2021-10-281-0/+350