rxdock::BaseMolecularDataSource Class Reference

Inheritance diagram for rxdock::BaseMolecularDataSource:

Public Member Functions
	BaseMolecularDataSource (std::string strName)
std::string	GetName ()
virtual bool	isTitleListSupported ()
virtual bool	isAtomListSupported ()
virtual bool	isCoordinatesSupported ()
virtual bool	isBondListSupported ()
virtual void	Reset ()=0
virtual int	GetNumTitles ()=0
virtual int	GetNumAtoms ()=0
virtual int	GetNumBonds ()=0
virtual int	GetNumSegments ()=0
virtual std::vector< std::string >	GetTitleList ()=0
virtual AtomList	GetAtomList ()=0
virtual BondList	GetBondList ()=0
virtual SegmentMap	GetSegmentMap ()=0
virtual bool	isDataSupported ()
virtual int	GetNumData ()=0
virtual std::vector< std::string >	GetDataFieldList ()=0
virtual StringVariantMap	GetDataMap ()=0
virtual bool	isDataFieldPresent (const std::string &strDataField)=0
virtual Variant	GetDataValue (const std::string &strDataField)=0

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

• BaseMolecularDataSource.h