SLAE: Strictly Local All-atom Environment for Protein Representation #1
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| name: CI | |
| on: | |
| push: | |
| branches: [main, release] | |
| pull_request: | |
| jobs: | |
| smoke: | |
| runs-on: ubuntu-latest | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| python-version: ["3.10", "3.11", "3.12"] | |
| steps: | |
| - uses: actions/checkout@v4 | |
| - uses: actions/setup-python@v5 | |
| with: | |
| python-version: ${{ matrix.python-version }} | |
| - name: Install CPU torch + PyG companion wheels | |
| run: | | |
| python -m pip install --upgrade pip | |
| pip install torch --index-url https://download.pytorch.org/whl/cpu | |
| TORCH_VER=$(python -c "import torch; print(torch.__version__.split('+')[0])") | |
| pip install torch-scatter torch-cluster torch-sparse \ | |
| -f "https://data.pyg.org/whl/torch-${TORCH_VER}+cpu.html" | |
| - name: Install SLAE (dev) | |
| run: pip install -e ".[dev]" | |
| - name: Lint | |
| run: ruff check SLAE scripts tests | |
| - name: Tests | |
| run: pytest -q |