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path: root/sci-chemistry/gromacs/gromacs-9999.ebuild
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* 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: Fix docs build for pdf manualAlexey Shvetsov2023-06-291-0/+4
* 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: Fix manual buildAlexey Shvetsov2022-12-221-1/+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 Shvetsov2022-12-201-7/+23
* sci-chemistry/gromacs: Add 2023.x release seriesAlexey Shvetsov2022-12-201-4/+2
* sci-chemistry/gromacs: Fix pep517Alexey Shvetsov2022-12-201-1/+2
* sci-chemistry/gromacs: Update 9999Alexey 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 Shvetsov2021-10-281-11/+5
* sci-chemistry/gromacs: revbump for subslot operator changesSam James2021-10-261-1/+1
* sci-chemistry/gromacs: Needs to be rebuilt with lmfit soname changesPacho Ramos2021-10-261-1/+1
* sci-chemistry/gromacs: fix confusing indentationSam James2021-10-141-6/+6
* sci-chemistry/gromacs: fix configure with -custom-cflagsSam James2021-10-141-1/+2
* sci-chemistry/gromacs: Needs to be rebuilt with hwlocPacho Ramos2021-08-251-1/+1
* sci-chemistry/gromacs: PYTHON_MULTI_USEDEP -> PYTHON_USEDEPDavid Seifert2021-07-171-2/+2
* sci-chemistry/gromacs: Fix manual useAlexey Shvetsov2021-06-181-25/+36
* sci-chemistry/gromacs: Needs cuda_profiler_api.h to buildPacho Ramos2021-06-151-1/+1
* sci-chemistry/gromacs: Fix pkgcheck errorAlexey Shvetsov2021-06-021-1/+1
* sci-chemistry/gromacs: fix cmake_src_make -> cmake_src_compileSam James2021-05-111-1/+1
* sci-chemistry/gromacs: Update patchesAlexey Shvetsov2021-04-231-2/+0
* sci-chemistry/gromacs: eutils--Sam James2021-04-161-1/+1
* sci-chemistry/gromacs: fix variable referencesSam James2021-04-031-2/+2
* */*: Remove obsolete values from PYTHON_COMPATMichał Górny2021-01-311-1/+1
* sci-chemistry/gromacs: drop x86-macosFabian Groffen2021-01-061-2/+2
* sci-chemistry/gromacs: Update URI'sAlexey Shvetsov2020-11-111-5/+5
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2020-10-271-20/+29
* sci-chemistry/gromacs: added py39Alexey Shvetsov2020-10-141-1/+1
* sci-chemistry/gromacs: Migrate cmake-utils -> cmakeAlexey Shvetsov2020-07-091-12/+12
* sci-chemistry/gromacs: Switch to PYTHON_MULTI_USEDEP APIMichał Górny2020-02-091-1/+3
* */*: Clean PYTHON_COMPAT of obsolete implsMichał Górny2020-01-051-1/+1
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2020-01-021-12/+63
* sci-chemistry/gromacs: Fix some pkgchek warningsAlexey Shvetsov2019-10-041-0/+2
* sci-chemistry/gromacs: http -> https for repo.or.czAlexey Shvetsov2019-06-031-3/+3