Normalise lambda and lambda_values as :.5f strings #52
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| name: Pull-Request | |
| on: | |
| pull_request: | |
| branches: [devel, main] | |
| jobs: | |
| build: | |
| name: build (${{ matrix.python-version }}, ${{ matrix.platform.name }}) | |
| runs-on: ${{ matrix.platform.os }} | |
| strategy: | |
| max-parallel: 9 | |
| fail-fast: false | |
| matrix: | |
| python-version: ["3.10", "3.11", "3.12"] | |
| platform: | |
| - { name: "linux", os: "ubuntu-latest", shell: "bash -l {0}" } | |
| - { name: "macos", os: "macos-latest", shell: "bash -l {0}" } | |
| exclude: | |
| # Exclude all but the latest Python from macOS | |
| - platform: | |
| { name: "macos", os: "macos-latest", shell: "bash -l {0}" } | |
| python-version: "3.10" | |
| - platform: | |
| { name: "macos", os: "macos-latest", shell: "bash -l {0}" } | |
| python-version: "3.11" | |
| environment: | |
| name: somd2-build | |
| defaults: | |
| run: | |
| shell: ${{ matrix.platform.shell }} | |
| env: | |
| SIRE_DONT_PHONEHOME: 1 | |
| SIRE_SILENT_PHONEHOME: 1 | |
| steps: | |
| # | |
| - uses: actions/checkout@v4 | |
| with: | |
| fetch-depth: 0 | |
| # | |
| - name: Compute version info | |
| shell: bash | |
| run: python actions/update_recipe.py | |
| # | |
| - name: Create sdist | |
| run: pip install build && python -m build --sdist && mv dist/*.tar.gz somd2-source.tar.gz | |
| working-directory: ${{ github.workspace }} | |
| # | |
| - name: Install pixi | |
| uses: prefix-dev/[email protected] | |
| with: | |
| run-install: false | |
| # | |
| - name: Install rattler-build | |
| shell: bash | |
| run: pixi global install rattler-build | |
| # | |
| - name: Write Python variant config | |
| shell: bash | |
| run: printf 'python:\n - "${{ matrix.python-version }}"\n' > "${{ github.workspace }}/python_variant.yaml" | |
| # | |
| - name: Build package using rattler-build (main channel) | |
| if: ${{ github.base_ref == 'main' }} | |
| shell: bash | |
| run: rattler-build build --recipe "${{ github.workspace }}/recipes/somd2" -c conda-forge -c openbiosim/label/main --variant-config "${{ github.workspace }}/python_variant.yaml" | |
| # | |
| - name: Build package using rattler-build (dev channel) | |
| if: ${{ github.base_ref != 'main' }} | |
| shell: bash | |
| run: rattler-build build --recipe "${{ github.workspace }}/recipes/somd2" -c conda-forge -c openbiosim/label/dev --variant-config "${{ github.workspace }}/python_variant.yaml" |