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Chemical Data Processing Library C++ API - Version 1.1.1
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29 #ifndef CDPL_CHEM_SDFMOLECULARGRAPHWRITER_HPP
30 #define CDPL_CHEM_SDFMOLECULARGRAPHWRITER_HPP
143 operator const void*()
const;
151 typedef std::unique_ptr<MDLDataWriter> MDLDataWriterPtr;
153 std::ostream& output;
155 MDLDataWriterPtr writer;
160 #endif // CDPL_CHEM_SDFMOLECULARGRAPHWRITER_HPP
Definition of the class CDPL::Base::DataWriter.
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.
Base::DataWriter< MolecularGraph > & write(const MolecularGraph &molgraph)
Writes data of the molecular graph molgraph to the output stream specified in the constructor.
SDFMolecularGraphWriter(std::ostream &os)
Constructs a SDFMolecularGraphWriter instance that will write data of molecular graphs to the output ...
MolecularGraph.
Definition: MolecularGraph.hpp:52
A writer for molecular graph data in the MDL Mol-File [CTFILE] format.
Definition: SDFMolecularGraphWriter.hpp:121
The namespace of the Chemical Data Processing Library.
~SDFMolecularGraphWriter()
Destructor.
An interface for writing data objects of a given type to an arbitrary data sink.
Definition: DataWriter.hpp:63