CI #401
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| name: CI | |
| on: | |
| push: | |
| branches: | |
| - "main" | |
| pull_request: | |
| branches: | |
| - "main" | |
| schedule: | |
| - cron: "0 0 * * *" | |
| jobs: | |
| test: | |
| defaults: | |
| run: | |
| shell: bash -l {0} | |
| name: MagPy Test ${{ matrix.os }}, Python ${{ matrix.python-version }} | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| fail-fast: true | |
| matrix: | |
| os: [macOS-latest, ubuntu-latest] | |
| python-version: ['3.8', '3.9', '3.10', '3.11'] | |
| steps: | |
| - uses: actions/checkout@v3 | |
| - name: Additional info about the build | |
| shell: bash | |
| run: | | |
| uname -a | |
| df -h | |
| ulimit -a | |
| - name: Create Psi4 Environment | |
| uses: conda-incubator/setup-miniconda@v3 | |
| with: | |
| miniconda-version: "latest" | |
| activate-environment: p4env | |
| environment-file: devtools/conda-envs/psi.yaml | |
| python-version: ${{ matrix.python-version }} | |
| auto-activate-base: true | |
| - name: Install Psi4 | |
| run: | | |
| conda info | |
| conda list --show-channel-urls | |
| hash -r | |
| env | |
| conda install psi4 python=${{ matrix.python-version }} numpy=1 -c conda-forge | |
| ls -l $CONDA | |
| - name: Test Psi4 Python Loading | |
| run: | | |
| export PATH=$CONDA_PREFIX/bin:$PATH | |
| export PYTHONPATH=$CONDA_PREFIX/lib:$PYTHONPATH | |
| conda env list | |
| python -c "import psi4" | |
| - name: Install MagPy and Deps | |
| run: | | |
| pip install -e . | |
| pip install pytest | |
| - name: Test and generate coverage report | |
| run: | | |
| pip install coverage | |
| coverage run -m pytest | |
| coverage xml | |
| ls -l | |
| - name: Upload coverage reports to Codecov | |
| uses: codecov/codecov-action@v3 | |
| env: | |
| CODECOV_TOKEN: ${{ secrets.CODECOV_TOKEN }} |