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SYCL: Avoid using no_init read accessor in rocFFT
[alexxy/gromacs.git] / python_packaging / src / gmxapi /
2021-11-04 M. Eric IrrgangFix typo. tree | commitdiff
2021-10-27 M. Eric IrrgangMark gmxapi 0.3b1. tree | commitdiff
2021-10-21 M. Eric IrrgangClean up some gmxapi sources and tests. tree | commitdiff
2021-10-18 Andrey AlekseenkoMerge release-2021 into master tree | commitdiff
2021-10-15 M. Eric IrrgangRequire pybind 2.6 from environment for gmxapi Python... tree | commitdiff
2021-09-14 Andrey AlekseenkoMerge remote-tracking branch 'origin/release-2021'... tree | commitdiff
2021-08-19 Andrey AlekseenkoMerge remote-tracking branch 'origin/release-2021'... tree | commitdiff
2021-08-16 M. Eric IrrgangUpdates for updated Python version requirement. tree | commitdiff
2021-08-11 M. Eric IrrgangAllow gmxapi Python package to build with all 2021... tree | commitdiff
2021-06-29 Paul BauerMerge branch release-2021 into master tree | commitdiff
2021-06-29 M. Eric IrrgangAllow gmxapi.commandline.cli to check GMXBIN. tree | commitdiff
2021-06-28 M. Eric IrrgangRestore gmxapi._gmxapi.add_mdmodule() Python functionality. tree | commitdiff
2021-06-24 M. Eric IrrgangLet gmxapi.commandline access GROMACS installation... tree | commitdiff
2021-05-07 Paul BauerMerge branch release-2021 into merge-2021-into-master tree | commitdiff
2021-03-05 Paul BauerMerge branch release-2020 into merge-2020-into-2021 tree | commitdiff
2021-02-12 Mark AbrahamMerge branch release-2021 into master tree | commitdiff
2021-01-29 Mark AbrahamMerge branch release-2021 tree | commitdiff
2021-01-24 M. Eric IrrgangFinalize gmxapi Python package version 0.2. tree | commitdiff
2021-01-07 Paul BauerMerge branch release-2020 into merge-2020-into-2021 tree | commitdiff
2020-12-18 Mark AbrahamMerge branch release-2021 tree | commitdiff
2020-12-16 M. Eric IrrgangApply re-formatting to C++ in src/ tree. tree | commitdiff
2020-11-24 Paul BauerMerge branch 'origin/release-2021' into merge-2021... tree | commitdiff
2020-11-24 Paul BauerMerge branch 'origin/release-2020' into merge-2020... tree | commitdiff
2020-11-18 M. Eric IrrgangReplace gmxapi `erroroutput` with `stderr` and `stdout` tree | commitdiff
2020-11-16 M. Eric Irrganggmxapi versioning updates. tree | commitdiff
2020-10-20 Paul BauerMerge branch 'origin/release-2020' into merge-release... tree | commitdiff
2020-10-07 Paul BauerMerge branch 'origin/release-2020' into merge-release... tree | commitdiff
2020-10-02 M. Eric IrrgangHandle gmxapi tmpi parameters better. tree | commitdiff
2020-10-02 M. Eric IrrgangLet gmxapi installation record the GROMACS library... tree | commitdiff
2020-09-30 M. Eric IrrgangRestrict gmxapi pytest tests to `-nt 2` tree | commitdiff
2020-09-29 M. Eric IrrgangAllow MPI-enabled clients to provide the library commun... tree | commitdiff
2020-08-31 Paul BauerMerge branch 'release-2020' into master tree | commitdiff
2020-08-03 M. Eric IrrgangPrevent failed commandline_operation from publishing... tree | commitdiff
2020-07-30 M. Eric IrrgangIgnore a generated file. tree | commitdiff
2020-06-22 M. Eric IrrgangUse Gromacs::gmx target to hint gmxapi tests. tree | commitdiff
2020-06-09 M. Eric IrrgangImprove usage of Python logging module. tree | commitdiff
2020-05-06 Paul BauerMerge branch 'origin/release-2020' into master tree | commitdiff
2020-04-08 M. Eric IrrgangExplicitly set UTF-8 encoding for gmxapi CLI interaction. tree | commitdiff
2020-04-03 M. Eric IrrgangPrune change-management.rst and update links. tree | commitdiff
2020-03-04 Paul BauerMerge branch release-2020 into master tree | commitdiff
2020-02-28 Paul BauerMerge branch release-2019 into release-2020 tree | commitdiff
2020-02-24 M. Eric IrrgangFix docstring bugs. tree | commitdiff
2020-02-24 M. Eric IrrgangLet commandline_operation accept stdin. tree | commitdiff
2020-02-24 M. Eric IrrgangMake gmxapi.version.has_feature warning more useful. tree | commitdiff
2020-02-24 M. Eric IrrgangUse subprocess.run instead of subprocess.check tree | commitdiff
2020-02-24 M. Eric IrrgangImprove gmxapi.operation error handling. tree | commitdiff
2020-01-28 Paul BauerMerge branch origin/release-2020 into master tree | commitdiff
2020-01-09 M. Eric IrrgangUse enum for gmxapi.testsupport fixture options. tree | commitdiff
2020-01-09 M. Eric IrrgangFurther consolidate gmxapi.testsupport. tree | commitdiff
2020-01-09 M. Eric IrrgangUpdate gmxapi Python package version and versioning... tree | commitdiff
2020-01-08 Roland SchulzMerge release-2019 into release-2020 tree | commitdiff
2020-01-07 Paul BauerMerge branch origin/release-2020 into master tree | commitdiff
2020-01-07 Paul BauerMerge commit d30f2cb6 from release-2020 into master tree | commitdiff
2019-12-30 M. Eric IrrgangMake gmxapi.testsupport usable as a pytest plugin. tree | commitdiff
2019-12-27 Paul BauerMerge origin/release-2019 into release-2020 tree | commitdiff
2019-12-26 M. Eric IrrgangClean up Sphinx interpreted text in the default role. tree | commitdiff
2019-12-07 M. Eric IrrgangFinalize gmxapi 0.1 tree | commitdiff
2019-11-29 Mark AbrahamMerge branch release-2019 into release-2020 tree | commitdiff
2019-11-20 Paul BauerMerge 'origin/release-2019' into release-2020 tree | commitdiff
2019-11-11 M. Eric IrrgangAchieve gmxapi fr15. tree | commitdiff
2019-11-11 M. Eric IrrgangUpdate notes and tests regarding gmxapi acceptance... tree | commitdiff
2019-11-11 M. Eric IrrgangAchieve gmxapi fr15. tree | commitdiff
2019-11-11 M. Eric IrrgangUpdate notes and tests regarding gmxapi acceptance... tree | commitdiff
2019-11-08 M. Eric IrrgangFix bug introduced by clang-format reformat. tree | commitdiff
2019-11-08 M. Eric IrrgangFix bug introduced by clang-format reformat. tree | commitdiff
2019-11-07 Paul BauerApply clang-format to source tree tree | commitdiff
2019-11-03 M. Eric IrrgangFix typos. tree | commitdiff
2019-10-29 Paul BauerMerge branch 'release-2019' into master tree | commitdiff
2019-10-21 M. Eric IrrgangAdd trajectory output to mdrun operation. tree | commitdiff
2019-10-16 M. Eric IrrgangMinor tidying to mdrun.py tree | commitdiff
2019-10-16 M. Eric IrrgangMinor clean-up to gmxapi package. tree | commitdiff
2019-10-16 M. Eric IrrgangUpdate gmxapi.version module. tree | commitdiff
2019-10-15 M. Eric IrrgangFix logic error in StaticSourceManager intialization. tree | commitdiff
2019-10-14 M. Eric IrrgangFix logic error in gmxapi.version.api_is_at_least(). tree | commitdiff
2019-10-12 M. Eric IrrgangImprove parameter typing for gmxapi simulation paramete... tree | commitdiff
2019-10-03 M. Eric IrrgangBuild gmxapi documentation in main GROMACS documentation. tree | commitdiff
2019-09-25 Szilárd PállMerge remote-tracking branch 'origin/release-2019' tree | commitdiff
2019-09-24 Paul BauerMerge branch release-2019 into master tree | commitdiff
2019-09-15 Peter KassonPatch gmxapi for Python 3.7 tree | commitdiff
2019-09-11 M. Eric IrrgangAdd gmxapi.modify_input operation. tree | commitdiff
2019-09-11 M. Eric IrrgangProvide a gmxapi.read_tpr operation. tree | commitdiff
2019-09-11 M. Eric IrrgangUpdate gmxapi.simulation.context details. tree | commitdiff
2019-09-11 M. Eric IrrgangAllow gmxapi.mdrun to properly dispatch simulation... tree | commitdiff
2019-09-11 M. Eric IrrgangUpdate gmxapi Python package infrastructure for new... tree | commitdiff
2019-09-11 M. Eric IrrgangNormalize some testing resources for the Python packages. tree | commitdiff
2019-09-03 M. Eric IrrgangPython wrapping code for gmxapi mdrun bindings. tree | commitdiff
2019-08-30 M. Eric IrrgangImport base code for Python-driven simulation from... tree | commitdiff
2019-08-26 M. Eric IrrgangRearrange exposure of gmxapicompat simulation input... tree | commitdiff
2019-08-26 M. Eric IrrgangMove gmxapicompat TPR tools to libgmxapi. tree | commitdiff
2019-08-22 Mark AbrahamMerge branch release-2019 tree | commitdiff
2019-08-22 M. Eric IrrgangC++ code and Python bindings for TPR parameter read... tree | commitdiff
2019-08-19 M. Eric IrrgangClean up gmxapi documentation build. tree | commitdiff
2019-08-19 M. Eric IrrgangAdd subgraph and while_loop operations. tree | commitdiff
2019-08-13 M. Eric IrrgangMap gmxapi C++ exceptions to Python exceptions. tree | commitdiff
2019-08-12 M. Eric IrrgangIntroduce Context requirement. tree | commitdiff
2019-08-12 M. Eric IrrgangSeparate out some abstract base classes. tree | commitdiff
2019-08-06 M. Eric IrrgangSeparate out OperationDetailsBase. tree | commitdiff
2019-08-06 M. Eric IrrgangResolve a compiler warning for the gmxapi Python package. tree | commitdiff
2019-08-05 M. Eric IrrgangSeparate out OperationDirector. tree | commitdiff
2019-08-02 M. Eric IrrgangRearchitect gmxapi.operation tree | commitdiff
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