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https://github.com/rdkit/rdkit.git
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45bf58754a
* change minimal cmake version to a consistent 3.5 * progress towards a cleanup * get the basic python deps working * two more libs * another round of changes all tests pass at this point * next round of changes all tests pass at this point * close to done all tests pass * very close * almost done * shift the RDBoost dependencies around a bit * remove an extraneous python linkage this is trying to get the mac builds working again * Only link to python if it was built shared (#3091) * change in response to review Co-Authored-By: Ric <ricrogz@users.noreply.github.com> * move that suppression of the maybe-uninitialized warning to BoostStartInclude.h Co-authored-by: Brian Kelley <fustigator@gmail.com> Co-authored-by: Ric <ricrogz@users.noreply.github.com>
82 lines
2.7 KiB
CMake
82 lines
2.7 KiB
CMake
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remove_definitions(-DRDKIT_GRAPHMOL_BUILD)
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add_definitions(-DRDKIT_FILEPARSERS_BUILD)
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if(RDK_USE_BOOST_IOSTREAMS)
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if(WIN32)
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find_package(Boost 1.56.0 COMPONENTS system iostreams REQUIRED)
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find_package(Boost 1.56.0 COMPONENTS zlib)
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set (link_iostreams ${Boost_LIBRARIES})
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if (NOT Boost_USE_STATIC_LIBS)
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add_definitions("-DBOOST_IOSTREAMS_DYN_LINK")
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endif()
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else()
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find_package(Boost 1.56.0 COMPONENTS system iostreams REQUIRED)
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set (link_iostreams ${Boost_LIBRARIES})
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if (NOT Boost_USE_STATIC_LIBS)
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add_definitions("-DBOOST_IOSTREAMS_DYN_LINK")
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endif()
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endif()
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ADD_DEFINITIONS("-DRDK_USE_BOOST_IOSTREAMS")
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endif(RDK_USE_BOOST_IOSTREAMS)
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if(RDK_BUILD_COORDGEN_SUPPORT)
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include_directories(${maeparser_INCLUDE_DIRS})
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set (maesupplier MaeMolSupplier.cpp)
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endif()
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if(RDK_USE_BOOST_REGEX)
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add_definitions(-DRDKIT_USE_BOOST_REGEX)
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find_package(Boost 1.58.0 COMPONENTS regex REQUIRED)
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set(regex_lib Boost::regex)
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endif()
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rdkit_library(FileParsers
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Mol2FileParser.cpp MolFileParser.cpp
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MolSGroupParsing.cpp MolSGroupWriting.cpp
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MolFileStereochem.cpp MolFileWriter.cpp
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ForwardSDMolSupplier.cpp SDMolSupplier.cpp SDWriter.cpp
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SmilesMolSupplier.cpp SmilesWriter.cpp
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TDTMolSupplier.cpp TDTWriter.cpp
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TplFileParser.cpp TplFileWriter.cpp
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PDBParser.cpp PDBWriter.cpp PDBSupplier.cpp
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XYZFileWriter.cpp
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${maesupplier}
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ProximityBonds.cpp
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SequenceParsers.cpp SequenceWriters.cpp
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SVGParser.cpp
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LINK_LIBRARIES Depictor SmilesParse GraphMol ${RDK_COORDGEN_LIBS} ${regex_lib} ${link_iostreams})
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rdkit_headers(FileParsers.h
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FileParserUtils.h
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MolFileStereochem.h
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MolSupplier.h
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MolWriters.h
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SequenceParsers.h SequenceWriters.h
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DEST GraphMol/FileParsers)
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rdkit_test(fileParsersTest1 test1.cpp
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LINK_LIBRARIES FileParsers SubstructMatch )
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rdkit_test(testMolSupplier testMolSupplier.cpp
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LINK_LIBRARIES FileParsers RDStreams)
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rdkit_test(testMolWriter testMolWriter.cpp LINK_LIBRARIES FileParsers )
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rdkit_test(testTplParser testTpls.cpp LINK_LIBRARIES FileParsers )
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rdkit_test(testMol2ToMol testMol2ToMol.cpp LINK_LIBRARIES FileParsers )
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rdkit_test(testSequence testSequence.cpp LINK_LIBRARIES FileParsers )
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rdkit_test(testExtendedStereoParsing testExtendedStereoParsing.cpp
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LINK_LIBRARIES FileParsers )
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rdkit_catch_test(fileParsersCatchTest file_parsers_catch.cpp catch_main.cpp
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LINK_LIBRARIES FileParsers )
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rdkit_catch_test(testPropertyLists testPropertyLists.cpp catch_main.cpp
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LINK_LIBRARIES FileParsers )
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