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* first pass at adding a SubstructMatchParameter struct * start moving the rest of the backend to use the parameters * backend at least mostly moved over * add aromaticMatchesConjugated add tests * switch over the MolBundle too Add templates to reduce duplicated code * support older compilers let's see if it works... * add SubstructMatchParameters to Python wrapper * remove some deprecations and warnings * damn compilers * parameter support for bundles in python wrapper * add the parameters to the java wrappers * response to review
17 lines
652 B
CMake
17 lines
652 B
CMake
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remove_definitions(-DRDKIT_GRAPHMOL_BUILD)
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add_definitions(-DRDKIT_SUBSTRUCTMATCH_BUILD)
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rdkit_library(SubstructMatch
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SubstructMatch.cpp SubstructUtils.cpp
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LINK_LIBRARIES GraphMol
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${RDKit_THREAD_LIBS} )
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rdkit_headers(SubstructMatch.h
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SubstructUtils.h DEST GraphMol/Substruct)
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rdkit_test(testSubstructMatch test1.cpp LINK_LIBRARIES FileParsers SmilesParse SubstructMatch
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GraphMol RDGeometryLib RDGeneral ${RDKit_THREAD_LIBS} )
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rdkit_catch_test(substructTestCatch catch_tests.cpp LINK_LIBRARIES FileParsers SmilesParse
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SubstructMatch GraphMol RDGeneral RDGeometryLib ${RDKit_THREAD_LIBS})
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