11 #ifndef __RD_FRAGMENT_CATALOG_UTILS_H__ 12 #define __RD_FRAGMENT_CATALOG_UTILS_H__ 22 namespace MolStandardize {
23 class FragmentCatalogParams;
26 std::string fileName);
28 std::istream &inStream,
int nToRead = -1);
pulls in the core RDKit functionality
RDKIT_MOLSTANDARDIZE_EXPORT std::vector< std::shared_ptr< ROMol > > readFuncGroups(std::string fileName)
#define RDKIT_MOLSTANDARDIZE_EXPORT