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| Original file line number | Diff line number | Diff line change |
|---|---|---|
| @@ -0,0 +1,57 @@ | ||
| name: RDKit Mac | ||
| on: | ||
| push: | ||
| branches: | ||
| - "**" | ||
| tags-ignore: | ||
| - "*" | ||
| paths: | ||
| - .github/workflows/rdkit-mac.yml | ||
|
|
||
| jobs: | ||
| build: | ||
| runs-on: macos-13 | ||
| steps: | ||
| - uses: actions/checkout@v4 | ||
| - run: | | ||
| brew install boost | ||
| git clone --recursive --branch Release_2024_03_5 https://github.com/rdkit/rdkit.git | ||
| cd rdkit | ||
| git apply ../extra/RDKit/inchi.patch | ||
| cmake -S . -B build \ | ||
| -DRDK_BUILD_CFFI_LIB=ON \ | ||
| -DRDK_BUILD_COORDGEN_SUPPORT=OFF \ | ||
| -DRDK_BUILD_CPP_TESTS=OFF \ | ||
| -DRDK_BUILD_DESCRIPTORS3D=OFF \ | ||
| -DRDK_BUILD_FREETYPE_SUPPORT=OFF \ | ||
| -DRDK_BUILD_INCHI_SUPPORT=OFF \ | ||
| -DRDK_BUILD_MAEPARSER_SUPPORT=OFF \ | ||
| -DRDK_BUILD_PYTHON_WRAPPERS=OFF \ | ||
| -DRDK_BUILD_QT_SUPPORT=OFF \ | ||
| -DRDK_BUILD_SLN_SUPPORT=OFF \ | ||
| -DRDK_OPTIMIZE_POPCNT=OFF \ | ||
| -DRDK_TEST_MMFF_COMPLIANCE=OFF \ | ||
| -DRDK_TEST_MULTITHREADED=OFF \ | ||
| -DRDK_USE_BOOST_IOSTREAMS=OFF \ | ||
| -DRDK_USE_BOOST_SERIALIZATION=OFF \ | ||
| -DRDK_USE_BOOST_STACKTRACE=OFF \ | ||
| -DRDK_USE_URF=OFF | ||
| cmake --build build --parallel 4 | ||
| mkdir dist | ||
| cp build/lib/librdkitcffi.2024.03.5.dylib dist/librdkitcffi.dylib | ||
| cp license.txt dist/rdkit-license.txt | ||
| cp Code/GraphMol/ChemReactions/license.txt dist/ChemReactions-license.txt | ||
| cp External/rapidjson-1.1.0/license.txt dist/rapidjson-license.txt | ||
| # Boost does not require license file for machine-executable object code | ||
| # Eigen not used if -DRDK_BUILD_DESCRIPTORS3D=OFF | ||
| # InChI not used if -DRDK_BUILD_INCHI_SUPPORT=OFF | ||
| # FreeType not used if -DRDK_BUILD_FREETYPE_SUPPORT=OFF | ||
| # CoordGen (coordgen and maeparser) not used if both -DRDK_BUILD_COORDGEN_SUPPORT=OFF and -DRDK_BUILD_MAEPARSER_SUPPORT=OFF | ||
| # RingDecomposerLib not used if -DRDK_USE_URF=OFF | ||
| env: | ||
| MACOSX_DEPLOYMENT_TARGET: 11.0 | ||
| - uses: actions/upload-artifact@v4 | ||
| with: | ||
| name: rdkit-2024.03.5-x86_64-darwin | ||
| path: rdkit/dist |