Use OpenMM 8.1 for CI tests (#32) #56
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| name: Linter | |
| on: | |
| push: | |
| branches: | |
| - "main" | |
| pull_request: | |
| branches: | |
| - "main" | |
| jobs: | |
| linter: | |
| name: Linter | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| matrix: | |
| os: [ubuntu-latest] | |
| python-version: ["3.10"] | |
| steps: | |
| - uses: actions/checkout@v3 | |
| - name: Additional info about the build | |
| shell: bash | |
| run: | | |
| uname -a | |
| df -h | |
| ulimit -a | |
| # More info on options: https://github.com/marketplace/actions/provision-with-micromamba | |
| - uses: mamba-org/provision-with-micromamba@main | |
| with: | |
| environment-file: devtools/conda-envs/lint_env.yaml | |
| environment-name: linter | |
| channels: conda-forge,defaults | |
| extra-specs: | | |
| python=${{ matrix.python-version }} | |
| - name: Install package | |
| # conda setup requires this special shell | |
| shell: bash -l {0} | |
| run: | | |
| python -m pip install . --no-deps | |
| micromamba list | |
| - name: Run flake8 | |
| shell: bash -l {0} | |
| run: flake8 ufedmm/ | |
| - name: Run black | |
| shell: bash -l {0} | |
| run: black --diff --color ufedmm/ | |
| - name: Run isort | |
| shell: bash -l {0} | |
| run: isort --check-only ufedmm/ |