feat: Add finetune method for MatterSim #170
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
| name: Build and Test with Mamba | |
| on: | |
| push: | |
| branches: | |
| - main | |
| pull_request: | |
| branches: | |
| - main | |
| jobs: | |
| build_and_test: | |
| runs-on: ubuntu-latest | |
| steps: | |
| - name: Checkout repository | |
| uses: actions/checkout@v3 | |
| - name: Set up Micromamba | |
| uses: mamba-org/setup-micromamba@v1 | |
| with: | |
| micromamba-version: 'latest' | |
| environment-file: environment.yaml | |
| init-shell: >- | |
| bash | |
| cache-environment: true | |
| post-cleanup: 'all' | |
| - name: Install dependencies | |
| run: | | |
| micromamba run -n mattersim uv pip install -e . | |
| - name: Install test dependencies | |
| run: | | |
| micromamba run -n mattersim uv pip install -e ".[dev]" | |
| - name: Build extension | |
| run: | | |
| micromamba run -n mattersim python setup.py build_ext --inplace | |
| - name: Run tests | |
| run: | | |
| micromamba run -n mattersim pytest -s tests |