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2021-10-21	M. Eric Irrgang	Improve detection of sphinx-build.	commit \| commitdiff \| tree
2021-10-21	M. Eric Irrgang	Clean up some gmxapi sources and tests.	commit \| commitdiff \| tree
2021-10-20	M. Eric Irrgang	Minor clean-up to docker build script.	commit \| commitdiff \| tree
2021-10-19	M. Eric Irrgang	Pre-install Python dependencies in CI Docker images.	commit \| commitdiff \| tree
2021-10-15	M. Eric Irrgang	Require pybind 2.6 from environment for gmxapi Python...	commit \| commitdiff \| tree
2021-10-11	M. Eric Irrgang	Normalize API tests.	commit \| commitdiff \| tree
2021-10-11	M. Eric Irrgang	More robust preparation for MPI tests.	commit \| commitdiff \| tree
2021-10-10	M. Eric Irrgang	Satisfy nblib dependencies with updated library targets.	commit \| commitdiff \| tree
2021-10-06	M. Eric Irrgang	Begin moving `script` boiler plate from YAML to shell...	commit \| commitdiff \| tree
2021-09-13	M. Eric Irrgang	Simplify MPI implementation checks.	commit \| commitdiff \| tree
2021-09-13	M. Eric Irrgang	Allow flexible requirements for gmxManageMPI.cmake	commit \| commitdiff \| tree
2021-09-06	M. Eric Irrgang	Describe procedure and labeling for MR closure.	commit \| commitdiff \| tree
2021-08-26	M. Eric Irrgang	Document Status labels for issues.	commit \| commitdiff \| tree
2021-08-11	M. Eric Irrgang	Allow gmxapi Python package to build with all 2021...	commit \| commitdiff \| tree
2021-08-09	M. Eric Irrgang	Fix GMX_PYTHON_PACKAGE option.	commit \| commitdiff \| tree
2021-08-09	M. Eric Irrgang	Minor clean-up to sample_restraint tests.	commit \| commitdiff \| tree
2021-06-29	M. Eric Irrgang	Test gmxapi and clients through Py 3.9.	commit \| commitdiff \| tree
2021-06-28	M. Eric Irrgang	Restore gmxapi._gmxapi.add_mdmodule() Python functionality.	commit \| commitdiff \| tree
2021-06-25	M. Eric Irrgang	apply reviewer suggestions	commit \| commitdiff \| tree
2021-06-24	M. Eric Irrgang	Let gmxapi.commandline access GROMACS installation...	commit \| commitdiff \| tree
2021-06-24	M. Eric Irrgang	Require Python 3.7 for gmxapi in GROMACS 2022	commit \| commitdiff \| tree
2021-03-03	M. Eric Irrgang	Create a documentation section for GitLab Label guidelines.	commit \| commitdiff \| tree
2020-11-29	M. Eric Irrgang	Improve accessibility of pytest documentation.	commit \| commitdiff \| tree
2020-11-20	M. Eric Irrgang	Create CMake targets for each of the modules.	commit \| commitdiff \| tree
2020-11-18	M. Eric Irrgang	Replace gmxapi `erroroutput` with `stderr` and `stdout`	commit \| commitdiff \| tree
2020-11-17	M. Eric Irrgang	Separate the testutils module.	commit \| commitdiff \| tree
2020-11-13	M. Eric Irrgang	Provide a catch-all target for library modules.	commit \| commitdiff \| tree
2020-11-12	M. Eric Irrgang	Provide common library headers through new CMake target.	commit \| commitdiff \| tree
2020-11-04	M. Eric Irrgang	Establish `api/` as the home for installed headers.	commit \| commitdiff \| tree
2020-10-27	M. Eric Irrgang	Use the correct CI script for sample_restraint jobs.	commit \| commitdiff \| tree
2020-10-27	M. Eric Irrgang	Update image names in job definitions.	commit \| commitdiff \| tree
2020-10-23	M. Eric Irrgang	Update Docker image build scripts.	commit \| commitdiff \| tree
2020-10-08	M. Eric Irrgang	Clarify the GMX_BUILD_MDRUN_ONLY full testing instructions.	commit \| commitdiff \| tree
2020-10-07	M. Eric Irrgang	Improve gmxPythonDiscovery.cmake	commit \| commitdiff \| tree
2020-10-01	M. Eric Irrgang	Use updated images for Python CI jobs.	commit \| commitdiff \| tree
2020-09-14	M. Eric Irrgang	Create and use SimulationInput module.	commit \| commitdiff \| tree
2020-09-09	M. Eric Irrgang	Explicitly include STL headers used in test.	commit \| commitdiff \| tree
2020-09-07	M. Eric Irrgang	Replace filename-based initialization functions.	commit \| commitdiff \| tree
2020-08-27	M. Eric Irrgang	Use a heap object for inputrec in gmx::Mdrunner::mdrunner().	commit \| commitdiff \| tree
2020-07-29	M. Eric Irrgang	Use GMXAPI CMake option guard for gmxapi target declaration.	commit \| commitdiff \| tree
2020-07-11	M. Eric Irrgang	Fix libgromacs CMake target install syntax.	commit \| commitdiff \| tree
2020-07-01	M. Eric Irrgang	Clean up simulatorbuilder.h	commit \| commitdiff \| tree
2020-05-29	M. Eric Irrgang	Handle arbitrary doxygen versions in Docker image build...	commit \| commitdiff \| tree
2020-05-26	M. Eric Irrgang	Normalize gmxapi related release-2020 job logic.	commit \| commitdiff \| tree
2020-05-25	M. Eric Irrgang	Reduce console log output from sample_restraint tests.	commit \| commitdiff \| tree
2020-05-14	M. Eric Irrgang	Reduce console log output from sample_restraint tests.	commit \| commitdiff \| tree
2020-05-12	M. Eric Irrgang	Refine usage of job:tags parameter.	commit \| commitdiff \| tree
2020-04-27	M. Eric Irrgang	Resolve static analyzer warnings from google tests.	commit \| commitdiff \| tree
2020-04-27	M. Eric Irrgang	Avoid temporary strings.	commit \| commitdiff \| tree
2020-04-24	M. Eric Irrgang	Update bundled pybind.	commit \| commitdiff \| tree
2020-04-23	M. Eric Irrgang	Use CMake 3.12+ facilities for detecting Python.	commit \| commitdiff \| tree
2020-04-14	M. Eric Irrgang	Fix invalid gitlab-ci.yml	commit \| commitdiff \| tree
2020-04-09	M. Eric Irrgang	Allow useful CI to run in forks	commit \| commitdiff \| tree
2020-04-07	M. Eric Irrgang	Prepare Python environments for GitLab CI pipeline.	commit \| commitdiff \| tree
2020-04-03	M. Eric Irrgang	Improve gmxapi Python package dependency resolution.	commit \| commitdiff \| tree
2020-04-03	M. Eric Irrgang	Prune change-management.rst and update links.	commit \| commitdiff \| tree
2020-04-02	M. Eric Irrgang	Modernize some Python subprocess calls.	commit \| commitdiff \| tree
2020-03-31	M. Eric Irrgang	Prepare Python environments for GitLab CI pipeline.	commit \| commitdiff \| tree
2020-03-31	M. Eric Irrgang	Update scripts for all of the requested pre-commit...	commit \| commitdiff \| tree
2020-03-30	M. Eric Irrgang	Require Python 3.6.	commit \| commitdiff \| tree
2020-03-27	M. Eric Irrgang	Compartmentalize hpccm build stages.	commit \| commitdiff \| tree
2020-03-27	M. Eric Irrgang	Be friendlier w.r.t. linkchecker.	commit \| commitdiff \| tree

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