CI with OpenMM on conda #1483
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| name: CI with OpenMM on conda | |
| on: | |
| push: | |
| branches: | |
| - "main" | |
| pull_request: | |
| branches: | |
| - "main" | |
| schedule: | |
| # Nightly tests run on master by default: | |
| # Scheduled workflows run on the latest commit on the default or base branch. | |
| # (from https://help.github.com/en/actions/reference/events-that-trigger-workflows#scheduled-events-schedule) | |
| - cron: "0 0 * * *" | |
| jobs: | |
| test: | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| os: [ubuntu-latest] | |
| python-version: [3.9] | |
| steps: | |
| - uses: actions/checkout@v2 | |
| # More info on options: https://github.com/conda-incubator/setup-miniconda | |
| - uses: conda-incubator/setup-miniconda@v2 | |
| with: | |
| python-version: ${{ matrix.python-version }} | |
| environment-file: devtools/conda-env.yml | |
| channels: conda-forge, pytorch, defaults | |
| activate-environment: test | |
| auto-update-conda: true | |
| auto-activate-base: false | |
| show-channel-urls: true | |
| - name: Install pip dependencies | |
| shell: bash -l {0} | |
| run: | | |
| pip install einops | |
| pip install nflows | |
| - name: Install package | |
| shell: bash -l {0} | |
| run: | | |
| python setup.py install | |
| - name: Test with pytest | |
| shell: bash -l {0} | |
| run: | | |
| pytest -vs |