rdkit_library(RascalMCES RascalMCES.cpp RascalCluster.cpp RascalButinaCluster.cpp lap_a_la_scipy.cpp PartitionSet.cpp RascalResult.cpp LINK_LIBRARIES SmilesParse FileParsers ChemTransforms SubstructMatch GraphMol) target_compile_definitions(RascalMCES PRIVATE RDKIT_RASCALMCES_BUILD) rdkit_headers(RascalMCES.h RascalOptions.h RascalClusterOptions.h RascalResult.h DEST GraphMol/RascalMCES) rdkit_catch_test(testRascalMCES mces_catch.cpp LINK_LIBRARIES RascalMCES) rdkit_catch_test(testRascalCluster mces_cluster_catch.cpp LINK_LIBRARIES RascalMCES) if (RDK_BUILD_PYTHON_WRAPPERS) add_subdirectory(Wrap) endif ()