Fixing maxchars for macos + update of github workflow #205
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| name: testing | |
| on: | |
| push: | |
| branches: | |
| - develop | |
| pull_request: | |
| jobs: | |
| lint: | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v3 | |
| - uses: actions/setup-python@v4 | |
| with: | |
| python-version: '3.13' | |
| cache: pip | |
| cache-dependency-path: pyproject.toml | |
| - name: Install dependencies | |
| run: | | |
| python -m pip install --upgrade pip | |
| pip install uv | |
| uv pip install --system .[msonable,tests,dev] | |
| - name: Lint | |
| run: pre-commit run --all-files --show-diff-on-failure | |
| build-test-bench: | |
| name: "Build test bench containers" | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v5 | |
| - name: Set up Docker Buildx | |
| uses: docker/setup-buildx-action@v3 | |
| - name: Build test bench container | |
| uses: docker/bake-action@v6 | |
| with: | |
| load: true | |
| push: false | |
| files: tests/integration/dockerfiles/docker-bake.hcl | |
| set: | | |
| *.cache-to=type=gha,scope=global,mode=max | |
| *.cache-from=type=gha,scope=global | |
| test: | |
| needs: [build-test-bench] | |
| strategy: | |
| matrix: | |
| config: | |
| - { os: macos-latest, python: "3.9", resolution: lowest-direct } | |
| - { os: ubuntu-latest, python: "3.9", resolution: lowest-direct } | |
| - { os: ubuntu-latest, python: "3.9", resolution: highest } | |
| - { os: ubuntu-latest, python: "3.10", resolution: highest } | |
| - { os: ubuntu-latest, python: "3.11", resolution: highest } | |
| - { os: ubuntu-latest, python: "3.12", resolution: highest } | |
| - { os: ubuntu-latest, python: "3.13", resolution: highest } | |
| - { os: ubuntu-latest, python: "3.14", resolution: lowest-direct } | |
| - { os: macos-latest, python: "3.14", resolution: highest } | |
| - { os: ubuntu-latest, python: "3.14", resolution: highest } | |
| runs-on: ${{ matrix.config.os }} | |
| steps: | |
| - uses: actions/checkout@v3 | |
| - uses: actions/setup-python@v4 | |
| with: | |
| python-version: ${{ matrix.config.python }} | |
| cache: pip | |
| cache-dependency-path: pyproject.toml | |
| - name: Set up Docker Buildx | |
| if: matrix.config.os == 'ubuntu-latest' | |
| uses: docker/setup-buildx-action@v3 | |
| - name: List images | |
| if: matrix.config.os == 'ubuntu-latest' | |
| run: docker images | |
| - name: Load test bench containers | |
| if: matrix.config.os == 'ubuntu-latest' | |
| uses: docker/bake-action@v6 | |
| with: | |
| load: true | |
| push: false | |
| files: tests/integration/dockerfiles/docker-bake.hcl | |
| set: | | |
| *.cache-to=type=gha,scope=global,mode=max | |
| *.cache-from=type=gha,scope=global | |
| - name: List images | |
| if: matrix.config.os == 'ubuntu-latest' | |
| run: docker images | |
| - name: Install dependencies | |
| run: | | |
| python -m pip install --upgrade pip | |
| pip install uv | |
| uv pip install --system .[msonable,remote,tests] --resolution=${{ matrix.config.resolution }} | |
| - name: Test | |
| if: matrix.config.os == 'ubuntu-latest' | |
| run: pytest --cov=qtoolkit --cov-report=xml | |
| - name: Test macos (no integration) | |
| if: matrix.config.os == 'macos-latest' | |
| run: pytest --ignore=tests/integration --cov=qtoolkit --cov-report=xml | |
| - name: Upload coverage to Codecov | |
| if: matrix.config.os == 'ubuntu-latest' && matrix.config.python == '3.13' && matrix.config.resolution == 'highest' | |
| uses: codecov/codecov-action@v3 | |
| with: | |
| token: ${{ secrets.CODECOV_TOKEN }} | |
| slug: matgenix/qtoolkit | |
| docs: | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v3 | |
| - uses: actions/setup-python@v4 | |
| with: | |
| python-version: '3.13' | |
| cache: pip | |
| cache-dependency-path: pyproject.toml | |
| - name: Install dependencies | |
| run: | | |
| python -m pip install -U pip | |
| pip install uv | |
| # Required to generate rst files from markdown | |
| sudo apt install pandoc | |
| uv pip install --system .[docs] | |
| - name: Build Sphinx docs | |
| working-directory: doc | |
| run: | | |
| # cannot use sphinx build directly as the makefile handles generation | |
| # of some rst files | |
| make html |