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path: root/sci-chemistry/gromacs
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* sci-chemistry/gromacs: version bump to 2021.4Alexey Shvetsov2021-11-092-0/+359
* sci-chemistry/gromacs: fix v2019 build on newer glibcChristoph Junghans2021-11-072-0/+293
* sci-chemistry/gromacs: needs mpi[cxx]Sam James2021-11-043-3/+3
* sci-chemistry/gromacs: Fix depsAlexey Shvetsov2021-11-043-3/+3
* sci-chemistry/gromacs: Unbundle muParserAlexey Shvetsov2021-11-043-30/+27
* sci-chemistry/gromacs: Add 2022_beta1Alexey Shvetsov2021-10-284-11/+708
* sci-chemistry/gromacs: revbump for subslot operator changesSam James2021-10-268-12/+12
* sci-chemistry/gromacs: Needs to be rebuilt with lmfit soname changesPacho Ramos2021-10-265-7/+7
* sci-chemistry/gromacs: fix confusing indentationSam James2021-10-143-18/+18
* sci-chemistry/gromacs: fix configure with -custom-cflagsSam James2021-10-143-3/+6
* sci-chemistry/gromacs: Stabilize 2021.3 arm, #814101Sam James2021-10-071-1/+1
* sci-chemistry/gromacs: Stabilize 2021.3 amd64, #814101Sam James2021-10-071-1/+1
* sci-chemistry/gromacs: Check patchesAlexey Shvetsov2021-09-151-6/+1
* sci-chemistry/gromacs: version bumpAlexey Shvetsov2021-09-152-0/+363
* **/metadata.xml: Replace http by https in DOCTYPE elementUlrich Müller2021-09-111-1/+1
* sci-chemistry/gromacs: Needs to be rebuilt with hwlocPacho Ramos2021-08-253-3/+3
* sci-chemistry/gromacs: PYTHON_MULTI_USEDEP -> PYTHON_USEDEPDavid Seifert2021-07-175-10/+10
* sci-chemistry/gromacs: Fix manual useAlexey Shvetsov2021-06-185-33/+52
* sci-chemistry/gromacs: drop oldAlexey Shvetsov2021-06-185-1424/+0
* sci-chemistry/gromacs: Allow to download manual instead of building itAlexey Shvetsov2021-06-1710-200/+279
* sci-chemistry/gromacs: Needs cuda_profiler_api.h to buildPacho Ramos2021-06-153-3/+3
* sci-chemistry/gromacs: Fix pkgcheck errorAlexey Shvetsov2021-06-0210-10/+10
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2021-06-022-0/+351
* sci-chemistry/gromacs: fix cmake_src_make -> cmake_src_compileSam James2021-05-1110-10/+10
* sci-chemistry/gromacs: remove ALLARCHESSam James2021-05-111-1/+0
* sci-chemistry/gromacs: Update patchesAlexey Shvetsov2021-04-2311-22/+97
* sci-chemistry/gromacs: eutils--Sam James2021-04-1610-10/+10
* sci-chemistry/gromacs: version bump to 2021.1Alexey Shvetsov2021-04-122-0/+348
* sci-chemistry/gromacs: version bump to 2020.6Alexey Shvetsov2021-04-122-0/+344
* sci-chemistry/gromacs: fix variable referencesSam James2021-04-036-12/+12
* sci-chemistry/gromacs: Version bump to releaseAlexey Shvetsov2021-02-012-2/+2
* */*: Remove obsolete values from PYTHON_COMPATMichał Górny2021-01-316-6/+6
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2021-01-132-2/+2
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2021-01-122-0/+344
* sci-chemistry/gromacs: Drop old versionAlexey Shvetsov2021-01-122-256/+0
* sci-chemistry/gromacs: drop x86-macosFabian Groffen2021-01-068-16/+16
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2020-12-032-2/+2
* sci-chemistry/gromacs: Stabilize 2019.6 ALLARCHES, #733574Sam James2020-11-131-1/+1
* sci-chemistry/gromacs: Stabilize 2020.4 ALLARCHES, #754084Sam James2020-11-131-1/+1
* sci-chemistry/gromacs: x86 stable (bug #754084)Thomas Deutschmann2020-11-121-1/+1
* sci-chemistry/gromacs: x86 stable (bug #733574)Thomas Deutschmann2020-11-121-1/+1
* sci-chemistry/gromacs: Update metadataAlexey Shvetsov2020-11-111-1/+1
* sci-chemistry/gromacs: New 2021_beta2Alexey Shvetsov2020-11-112-2/+2
* sci-chemistry/gromacs: Remove old 2020.x releasesAlexey Shvetsov2020-11-114-1032/+0
* sci-chemistry/gromacs: Update URI'sAlexey Shvetsov2020-11-1111-49/+57
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2020-10-274-20/+723
* sci-chemistry/gromacs: added py39Alexey Shvetsov2020-10-146-16/+20
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2020-10-102-0/+343
* sci-chemistry/gromacs: Migrate cmake-utils -> cmakeAlexey Shvetsov2020-07-098-87/+87
* sci-chemistry/gromacs: Version bumpAlexey Shvetsov2020-07-092-0/+343