v1.1.1 Improve AGOX compatibility #92
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| name: run-python-build | |
| on: | |
| pull_request: | |
| branches: | |
| - main | |
| - development | |
| types: | |
| - opened | |
| - synchronize | |
| paths: | |
| - ".github/workflows/python.yml" | |
| - "CMakeLists.txt" | |
| - "pyproject.toml" | |
| - "src/*.py" | |
| - "**.f90" | |
| - "**.F90" | |
| workflow_dispatch: | |
| permissions: | |
| contents: read | |
| pages: write | |
| id-token: write | |
| concurrency: | |
| group: python | |
| cancel-in-progress: false | |
| jobs: | |
| build-and-test-python: | |
| environment: | |
| name: github-pages | |
| name: Build and test in debug mode | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| os: [ubuntu-latest, macos-latest] | |
| python-version: [ "3.11", "3.12", "3.13" ] | |
| toolchain: | |
| - {fortran-compiler: gcc, fc-version: 14} | |
| build_type: [Serial, Release] | |
| steps: | |
| - name: checkout repo | |
| uses: actions/checkout@v4 | |
| - name: actions-setup-python ${{ matrix.python-version }} | |
| uses: actions/setup-python@v5 | |
| with: | |
| python-version: ${{ matrix.python-version }} | |
| - name: actions-setup-cmake | |
| uses: jwlawson/[email protected] | |
| with: | |
| cmake-version: '3.24.x' | |
| - uses: fortran-lang/setup-fortran@v1 | |
| id: setup-fortran | |
| with: | |
| compiler: ${{ matrix.toolchain.fortran-compiler }} | |
| version: ${{ matrix.toolchain.fc-version }} | |
| - name: Install python dependencies | |
| run: | | |
| python --version | |
| python -m pip install pip-tools | |
| python -m pip install pytest | |
| python -m pip install parameterized | |
| python -m piptools compile -o requirements.txt pyproject.toml --all-build-deps | |
| python -m pip install -r requirements.txt | |
| - name: Install OpenMP runtime (Linux only) | |
| if: runner.os == 'Linux' | |
| run: sudo apt-get update && sudo apt-get install -y libgomp1 | |
| - name: Build and install Python package with CMAKE_BUILD_TYPE=${{ matrix.build_type }} | |
| env: | |
| CMAKE_BUILD_TYPE: ${{ matrix.build_type }} | |
| run: | | |
| cmake --version | |
| echo "Building with CMAKE_BUILD_TYPE=${CMAKE_BUILD_TYPE}" | |
| python -m pip install ".[ase]" --config-settings="cmake.define.CMAKE_BUILD_TYPE=${CMAKE_BUILD_TYPE}" | |
| - name: Run tests | |
| run: | | |
| ${{ env.FC }} --version | |
| python -m pytest |