Make the MACE fit more flexible and build a finetuning workflow #354
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| # This workflow will install Python dependencies, run tests and lint with a variety of Python versions | |
| # For more information see: https://help.github.com/actions/language-and-framework-guides/using-python-with-github-actions | |
| name: Testing Linux | |
| on: | |
| workflow_dispatch: | |
| push: | |
| branches: [ main ] | |
| pull_request: | |
| branches: [ main ] | |
| jobs: | |
| build: | |
| runs-on: ubuntu-latest | |
| strategy: | |
| fail-fast: false | |
| matrix: | |
| python-version: ["3.10", "3.11"] | |
| split: [1, 2, 3, 4, 5] # Number of splits | |
| steps: | |
| - uses: actions/checkout@v3 | |
| - name: Run tests using Docker image for Python ${{ matrix.python-version }} | |
| run: | | |
| docker pull ghcr.io/autoatml/autoplex/autoplex:python-${{ matrix.python-version }} | |
| docker run --rm \ | |
| -v ${{ github.workspace }}:/workspace \ | |
| -w /workspace \ | |
| ghcr.io/autoatml/autoplex/autoplex:python-${{ matrix.python-version }} \ | |
| bash -c " | |
| python -m pip install --upgrade pip && \ | |
| python -m uv cache clean | |
| python -m uv pip install .[strict,tests] && \ | |
| OMP_NUM_THREADS=1 pytest --cache-clear --cov=autoplex --cov-report term-missing --cov-append --splits 5 --group ${{ matrix.split }} -vv --durations-path /workspace/tests/test_data/.pytest-split-durations | |
| " | |
| - name: Upload coverage | |
| uses: actions/upload-artifact@v3 | |
| with: | |
| name: coverage-${{ matrix.python-version }}-${{ matrix.split }} | |
| include-hidden-files: true | |
| overwrite: false | |
| path: ./.coverage | |
| coverage: | |
| needs: build | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v3 | |
| - name: Set up Python 3.10 | |
| uses: actions/setup-python@v4 | |
| with: | |
| python-version: '3.10' | |
| - name: Install Coverage | |
| run: | | |
| python -m pip install coverage[toml] | |
| - name: Download coverage artifacts | |
| continue-on-error: true | |
| uses: actions/download-artifact@v3 | |
| - name: Run coverage | |
| continue-on-error: true | |
| run: | | |
| coverage combine coverage*/.coverage* | |
| coverage report --show-missing | |
| docs: | |
| runs-on: ubuntu-latest | |
| defaults: | |
| run: | |
| shell: bash -l {0} # enables conda/mamba env activation by reading bash profile | |
| steps: | |
| - name: Check out repo | |
| uses: actions/checkout@v4 | |
| - name: Set up micromamba | |
| uses: mamba-org/setup-micromamba@main | |
| - name: Create mamba environment | |
| run: | | |
| micromamba create -n autoplex_docs python=3.10 --yes | |
| - name: Install uv | |
| run: micromamba run -n autoplex_docs pip install uv | |
| - name: Install autoplex and dependencies | |
| run: | | |
| micromamba activate autoplex_docs | |
| uv pip install --upgrade pip | |
| uv pip install .[docs,strict] | |
| - name: Build | |
| run: micromamba run -n autoplex_docs sphinx-build -W docs _build |