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RDKit
Open-source cheminformatics and machine learning.
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Functions | |
void | parseAtomType (const std::string &inLine, std::map< std::string, std::string > &atomTypeDefs, const unsigned int &lineNo) |
MolChemicalFeatureDef * | parseFeatureDef (std::istream &inStream, const std::string &inLine, unsigned int &lineNo, const std::map< std::string, std::string > &atomTypeDefs) |
void RDKit::Local::parseAtomType | ( | const std::string & | inLine, |
std::map< std::string, std::string > & | atomTypeDefs, | ||
const unsigned int & | lineNo | ||
) |
MolChemicalFeatureDef* RDKit::Local::parseFeatureDef | ( | std::istream & | inStream, |
const std::string & | inLine, | ||
unsigned int & | lineNo, | ||
const std::map< std::string, std::string > & | atomTypeDefs | ||
) |