RDKit::MolWriter Class Reference

#include <MolWriters.h>

Inheritance diagram for RDKit::MolWriter:

Public Member Functions
virtual	~MolWriter ()
virtual void	write (const ROMol &mol, int confId=defaultConfId)=0
virtual void	flush ()=0
virtual void	close ()=0
virtual void	setProps (const STR_VECT &propNames)=0
virtual unsigned int	numMols () const =0

Detailed Description

Definition at line 36 of file MolWriters.h.

Constructor & Destructor Documentation

~MolWriter()

virtual RDKit::MolWriter::~MolWriter ( )

inlinevirtual

Definition at line 38 of file MolWriters.h.

Member Function Documentation

close()

virtual void RDKit::MolWriter::close ( )

pure virtual

Implemented in RDKit::PDBWriter, RDKit::SDWriter, RDKit::SmilesWriter, and RDKit::TDTWriter.

flush()

virtual void RDKit::MolWriter::flush ( )

pure virtual

Implemented in RDKit::PDBWriter, RDKit::SDWriter, RDKit::SmilesWriter, and RDKit::TDTWriter.

numMols()

virtual unsigned int RDKit::MolWriter::numMols ( ) const

pure virtual

Implemented in RDKit::PDBWriter, RDKit::SDWriter, RDKit::SmilesWriter, and RDKit::TDTWriter.

setProps()

virtual void RDKit::MolWriter::setProps ( const STR_VECT & propNames )

pure virtual

Implemented in RDKit::PDBWriter, RDKit::SDWriter, RDKit::SmilesWriter, and RDKit::TDTWriter.

write()

virtual void RDKit::MolWriter::write ( const ROMol & mol, int confId = defaultConfId )

pure virtual

Implemented in RDKit::PDBWriter, RDKit::SDWriter, RDKit::SmilesWriter, and RDKit::TDTWriter.

References RDKit::defaultConfId.

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The documentation for this class was generated from the following file:

• MolWriters.h