Add enabling of CAMP for chemistry #794
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| name: tests+pypi | |
| defaults: | |
| run: | |
| shell: bash | |
| on: | |
| push: | |
| branches: [ main ] | |
| pull_request: | |
| branches: [ main ] | |
| schedule: | |
| - cron: '0 13 * * 4' | |
| release: | |
| types: [published] | |
| jobs: | |
| debug_build_ok: | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v2 | |
| with: | |
| submodules: recursive | |
| fetch-depth: 0 # https://github.com/pypa/setuptools_scm/issues/480 | |
| - run: DEBUG=1 VERBOSE=1 pip install --verbose -e .[tests] | |
| - run: pytest -v -s -We -p no:unraisableexception tests | |
| zenodo_json: | |
| runs-on: ubuntu-latest | |
| steps: | |
| - uses: actions/checkout@v2 | |
| - uses: notiz-dev/github-action-json-property@release | |
| with: | |
| path: '.zenodo.json' | |
| prop_path: 'creators' | |
| build: | |
| needs: [debug_build_ok, zenodo_json] | |
| strategy: | |
| matrix: | |
| include: | |
| - platform: windows-latest | |
| python-version: "3.7" | |
| - platform: windows-latest | |
| python-version: "3.8" | |
| - platform: windows-latest | |
| python-version: "3.9" | |
| - platform: windows-latest | |
| python-version: "3.10" | |
| - platform: windows-latest | |
| python-version: "3.11" | |
| - platform: macos-12 | |
| python-version: "3.7" | |
| - platform: macos-12 | |
| python-version: "3.8" | |
| - platform: macos-12 | |
| python-version: "3.9" | |
| - platform: macos-12 | |
| python-version: "3.10" | |
| - platform: macos-12 | |
| python-version: "3.11" | |
| - platform: macos-14 | |
| python-version: "3.10" | |
| - platform: macos-14 | |
| python-version: "3.11" | |
| - manylinux: "manylinux2010_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.7" | |
| - manylinux: "manylinux2010_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.8" | |
| - manylinux: "manylinux2010_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.9" | |
| - manylinux: "manylinux2010_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.10" | |
| - manylinux: "manylinux_2_24_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.7" | |
| - manylinux: "manylinux_2_24_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.8" | |
| - manylinux: "manylinux_2_24_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.9" | |
| - manylinux: "manylinux_2_24_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.10" | |
| - manylinux: "manylinux_2_24_x86_64" | |
| platform: ubuntu-latest | |
| python-version: "3.11" | |
| fail-fast: false | |
| runs-on: ${{ matrix.platform }} | |
| steps: | |
| - if: startsWith(matrix.platform, 'macos-') | |
| run: | | |
| brew reinstall gcc | |
| for i in /Applications/Xcode_*.app; do sudo xcode-select -s "$i"; break; done; | |
| echo MACOSX_DEPLOYMENT_TARGET=`sw_vers -productVersion` >> $GITHUB_ENV | |
| echo ARCHFLAGS="-arch `uname -m`" >> $GITHUB_ENV # this seems to have no effect on whl name on Python 3.11! | |
| - if: matrix.platform == 'windows-latest' | |
| uses: msys2/setup-msys2@v2 | |
| with: | |
| msystem: MINGW64 | |
| update: false | |
| install: >- | |
| mingw-w64-x86_64-gcc-fortran | |
| mingw-w64-x86_64-ninja | |
| m4 | |
| - if: matrix.platform == 'windows-latest' | |
| run: | | |
| echo CMAKE_ARGS="-DCMAKE_MAKE_PROGRAM=D:/a/_temp/msys64/mingw64/bin/ninja.exe" >> $GITHUB_ENV | |
| echo CMAKE_PROGRAM_PATH="D:/a/_temp/msys64/usr/bin" >> $GITHUB_ENV | |
| echo CMAKE_GENERATOR="Ninja" >> $GITHUB_ENV | |
| echo TEMP="D:/a/_temp/" >> $GITHUB_ENV | |
| - uses: jwlawson/actions-setup-cmake@v1.13 | |
| with: | |
| cmake-version: '3.26.x' | |
| - uses: actions/checkout@v2 | |
| with: | |
| submodules: recursive | |
| fetch-depth: 0 # https://github.com/pypa/setuptools_scm/issues/480 | |
| - uses: actions/setup-python@v5.0.0 | |
| with: | |
| python-version: ${{ matrix.python-version }} | |
| - run: python -m pip install --upgrade pip==22.1.2 | |
| - run: python -m pip install $PIP_INSTALL_OPTS "build<1.1" wheel | |
| - run: cmake --version | |
| - run: | | |
| unset CI | |
| python -m build 2>&1 | tee build.log | |
| exit `fgrep -i warning build.log | grep -v "WARNING setuptools_scm" | grep -v "-warnings" | grep -v "All Warnings are enabled" | wc -l` | |
| - if: startsWith(matrix.platform, 'macos-12') && matrix.python-version == '3.11' | |
| run: | | |
| # workaround for buggy universal2 wheel name with Python 3.11 (contains x86_64 binary only) | |
| for whl in dist/*_universal2.whl; do | |
| export whl_new=${whl/_universal2/_x86_64}; | |
| mv $whl $whl_new; | |
| python -m wheel unpack $whl_new; | |
| export whl_new_unpacked=`basename $whl_new | cut -d- -f-2`; | |
| sed -i '' 's/_universal2/_x86_64/g' $whl_new_unpacked/$whl_new_unpacked.dist-info/WHEEL; | |
| python -m wheel pack $whl_new_unpacked; | |
| done | |
| - if: matrix.platform == 'ubuntu-latest' | |
| run: rm dist/* | |
| - if: matrix.platform == 'ubuntu-latest' | |
| run: | | |
| python -c "import sys; vi=sys.version_info; abitag='m' if vi.minor<8 else ''; print(f'PV=cp{vi.major}{vi.minor}-cp{vi.major}{vi.minor}{abitag}')" >> $GITHUB_ENV | |
| - if: ${{ matrix.platform == 'ubuntu-latest' && matrix.manylinux == 'manylinux2010_x86_64' }} | |
| uses: RalfG/python-wheels-manylinux-build@v0.7.1-manylinux2010_x86_64 | |
| with: | |
| python-versions: ${{ env.PV }} | |
| build-requirements: 'setuptools_scm' | |
| pre-build-command: 'git config --global --add safe.directory "*"' | |
| - if: ${{ matrix.platform == 'ubuntu-latest' && matrix.manylinux == 'manylinux_2_24_x86_64' }} | |
| uses: RalfG/python-wheels-manylinux-build@v0.7.1-manylinux_2_24_x86_64 | |
| with: | |
| python-versions: ${{ env.PV }} | |
| build-requirements: 'setuptools_scm' | |
| pre-build-command: 'git config --global --add safe.directory "*"' | |
| - if: matrix.platform == 'ubuntu-latest' | |
| run: rm dist/*-linux_* | |
| # case sensitivity issue - avoid coexisting PyPartMC-... and pypartmc-... files | |
| # https://github.com/pypi/warehouse/issues/15824 | |
| - run: rm -f dist/pypartmc*.tar.gz | |
| - uses: actions/upload-artifact@v4 | |
| with: | |
| name: dist-${{matrix.platform}}-${{matrix.manylinux}}-${{matrix.python-version}} | |
| path: dist | |
| - env: | |
| SYSTEM_VERSION_COMPAT: 0 | |
| run: | | |
| python -m pip debug --verbose | |
| for i in dist/*.whl; do python -m pip install $PIP_INSTALL_OPTS $i[tests]; done; | |
| python -m pip show --verbose PyPartMC | |
| ### make sure PyPartMC is not picked up from a local folder | |
| - run: | | |
| cd tests | |
| python -c "import PyPartMC" | |
| python -m pytest --durations=10 -v -s -We -p no:unraisableexception . | |
| cd .. | |
| - if: matrix.python-version != '3.7' | |
| run: | | |
| python -m pip install $PIP_INSTALL_OPTS -r gitmodules/devops_tests/requirements.txt | |
| ex -sc 'g/^PyPartMC/d' -cx .binder/requirements.txt | |
| python -m pip install $PIP_INSTALL_OPTS -r .binder/requirements.txt | |
| GITHUB_TOKEN=${{ secrets.GITHUB_TOKEN }} python -m pytest --durations=10 -v -s -We -p no:unraisableexception gitmodules/devops_tests | |
| ### uncomment to gain ssh access in case of failure | |
| # - if: ${{ failure() }} | |
| # uses: mxschmitt/action-tmate@v3 | |
| # with: | |
| # limit-access-to-actor: true | |
| dist_check: | |
| runs-on: ubuntu-latest | |
| needs: [build] | |
| steps: | |
| - uses: actions/setup-python@v5.0.0 | |
| with: | |
| python-version: "3.11" | |
| - run: pip install twine auditwheel | |
| - uses: actions/download-artifact@v4 | |
| with: | |
| pattern: dist-* | |
| merge-multiple: true | |
| path: dist | |
| - run: twine check --strict dist/* | |
| - run: for i in dist/*-manylinux*.whl; do auditwheel show $i; done; | |
| dist_upload: | |
| runs-on: ubuntu-latest | |
| needs: [dist_check] | |
| permissions: | |
| id-token: write | |
| steps: | |
| - uses: actions/download-artifact@v4 | |
| with: | |
| pattern: dist-* | |
| merge-multiple: true | |
| path: dist | |
| - if: github.event_name == 'push' && github.ref == 'refs/heads/main' | |
| uses: pypa/gh-action-pypi-publish@unstable/v1 | |
| with: | |
| repository_url: https://test.pypi.org/legacy/ | |
| - run: | | |
| echo "github.event_name:" ${{ github.event_name }} | |
| echo "github.event.action:" ${{ github.event.action }} | |
| echo "github.event.prerelease:" ${{ github.event.prerelease }} | |
| echo "env.GITHUB_REF:" ${{ env.GITHUB_REF }} | |
| echo "env.GITHUB_REF:" ${{ env.GITHUB_REF_NAME }} | |
| - if: github.event_name == 'release' && github.event.prerelease == false | |
| uses: pypa/gh-action-pypi-publish@unstable/v1 |