Update mopac & mopactools versions #6
Workflow file for this run
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| name: CI | |
| on: | |
| push: | |
| branches: | |
| - main | |
| pull_request: | |
| branches: | |
| - main | |
| env: | |
| MOPAC_VERSION: 23.2.1 | |
| jobs: | |
| build-src: | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v4 | |
| - name: Build package | |
| shell: bash | |
| run: | | |
| pip install build | |
| python -m build | |
| - name: Save wheel artifacts | |
| uses: actions/upload-artifact@v4 | |
| with: | |
| name: src-tarball | |
| path: dist/*.gz | |
| build-wheel: | |
| name: Build on ${{ matrix.os }} | |
| runs-on: ${{ matrix.os }} | |
| strategy: | |
| matrix: | |
| os: [macos-13, ubuntu-latest, windows-latest] | |
| include: | |
| - osname: mac | |
| platform: macosx-10.13-universal2 | |
| arc: zip | |
| lib: dylib | |
| libdir: lib | |
| util: unzip | |
| os: macos-13 | |
| - osname: linux | |
| platform: manylinux_2_17_x86_64 | |
| arc: tar.gz | |
| lib: so* | |
| libdir: lib | |
| util: "tar -xvzf" | |
| os: ubuntu-latest | |
| - osname: win | |
| platform: win-amd64 | |
| arc: zip | |
| lib: dll | |
| libdir: bin | |
| util: unzip | |
| os: windows-latest | |
| steps: | |
| - uses: actions/checkout@v4 | |
| - name: Download the shared library from GitHub Release | |
| shell: bash | |
| run: | | |
| curl -OL https://github.com/openmopac/mopac/releases/download/v${{ env.MOPAC_VERSION }}/mopac-${{ env.MOPAC_VERSION }}-${{ matrix.osname }}.${{ matrix.arc }} | |
| ${{ matrix.util }} mopac-${{ env.MOPAC_VERSION }}-${{ matrix.osname }}.${{ matrix.arc }} | |
| mkdir src/mopactools/lib | |
| mv mopac-${{ env.MOPAC_VERSION }}-${{ matrix.osname }}/${{ matrix.libdir }}/*.${{ matrix.lib }} src/mopactools/lib | |
| ls src/mopactools/lib | |
| - name: Build package | |
| shell: bash | |
| run: | | |
| pip install build | |
| python -m build -C--build-option=--plat-name=${{ matrix.platform }} | |
| - name: Run tests | |
| shell: bash | |
| run: | | |
| pip install . | |
| pip install pytest | |
| pytest | |
| # I'll do this by hand for now... | |
| # - name: Deploy to PyPI | |
| # shell: bash | |
| # run: | | |
| # pip install twine==6.0.1 | |
| # python -m twine upload --repository testpypi dist/*.whl | |
| - name: Save wheel artifacts | |
| uses: actions/upload-artifact@v4 | |
| with: | |
| name: ${{ matrix.os }}-wheel | |
| path: dist/*.whl | |
| merge: | |
| runs-on: ubuntu-latest | |
| needs: [build-src, build-wheel] | |
| steps: | |
| - name: Merge Artifacts | |
| uses: actions/upload-artifact/merge@v4 | |
| with: | |
| name: mopactools-wheel | |
| delete-merged: true |