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Chemical Data Processing Library C++ API - Version 1.1.1
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29 #ifndef CDPL_CHEM_SMARTSMOLECULEREADER_HPP
30 #define CDPL_CHEM_SMARTSMOLECULEREADER_HPP
44 class SMARTSDataReader;
86 bool readData(std::istream&,
Molecule&,
bool overwrite);
87 bool skipData(std::istream&);
88 bool moreData(std::istream&);
90 typedef std::unique_ptr<SMARTSDataReader> SMARTSDataReaderPtr;
92 SMARTSDataReaderPtr reader;
97 #endif // CDPL_CHEM_SMARTSMOLECULEREADER_HPP
Definition of the preprocessor macro CDPL_CHEM_API.
#define CDPL_CHEM_API
Tells the compiler/linker which classes, functions and variables are part of the library API.
~SMARTSMoleculeReader()
Destructor.
Molecule.
Definition: Molecule.hpp:49
A reader for molecule data in the Daylight SMARTS [SMARTS] format.
Definition: SMARTSMoleculeReader.hpp:64
The namespace of the Chemical Data Processing Library.
SMARTSMoleculeReader(std::istream &is)
Constructs a SMARTSMoleculeReader instance that will read the molecule data from the input stream is.
Definition of the class CDPL::Util::StreamDataReader.
A helper class that implements Base::DataReader for std::istream based data readers.
Definition: StreamDataReader.hpp:73