feat: Ease MPNN command line usage #159
Workflow file for this run
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| name: test | |
| on: | |
| push: | |
| branches: [main, production, wip/for-release, wip/remove-chemdata] | |
| # Run on every pull request regardless of base branch, so stacked task-branch PRs | |
| # are gated too (not just PRs targeting the mainline branches above). | |
| pull_request: | |
| workflow_dispatch: | |
| concurrency: | |
| group: ${{ github.workflow }}-${{ github.ref }} | |
| cancel-in-progress: true | |
| jobs: | |
| mypy: | |
| name: mypy (type check) | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v4 | |
| - uses: actions/setup-python@v5 | |
| with: | |
| python-version: "3.12" | |
| cache: 'pip' | |
| cache-dependency-path: | | |
| pyproject.toml | |
| ci-constraints.txt | |
| - name: Install package + dev extras | |
| # `[dev]` pulls in mypy and the dev tooling. The package itself is needed | |
| # so mypy can resolve `import foundry.*` against the installed source. | |
| # `-c ci-constraints.txt` pins the type-stub-sensitive packages to the | |
| # validated versions so the gate is reproducible (see that file). | |
| run: pip install -e ".[dev]" -c ci-constraints.txt | |
| - name: mypy | |
| run: mypy | |
| pytest: | |
| name: pytest (shared + CPU model tests) | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v4 | |
| - uses: actions/setup-python@v5 | |
| with: | |
| python-version: "3.12" | |
| cache: 'pip' | |
| cache-dependency-path: | | |
| pyproject.toml | |
| ci-constraints.txt | |
| - name: Install package + dev extras | |
| # `-c ci-constraints.txt` pins the type-stub-sensitive packages to the | |
| # validated versions so the gate is reproducible (see that file). | |
| run: pip install -e ".[dev]" -c ci-constraints.txt | |
| - name: pytest | |
| # Runs the shared-layer tests/ plus the CPU-portable per-model tests under | |
| # models/*/tests/ (collected via `testpaths`; the model packages are importable | |
| # because `pip install -e .` exposes them). Each model's tests/conftest.py uses | |
| # `collect_ignore` to hold its cluster-coupled suite (GPU / downloaded checkpoints | |
| # / IPD data) out of CI — those run locally on the cluster. | |
| run: pytest |