RDKit::KeyHolderBase Class Reference

#include <SubstructLibrary.h>

Inheritance diagram for RDKit::KeyHolderBase:

Public Member Functions
virtual	~KeyHolderBase ()
virtual unsigned int	addMol (const ROMol &m)=0
	Add a key to the database getting it from the molecule.
virtual unsigned int	addKey (const std::string &)=0
virtual const std::string &	getKey (unsigned int) const =0
virtual std::vector< std::string >	getKeys (const std::vector< unsigned int > &indices) const =0
virtual unsigned int	size () const =0
	Get the current keeyholder size.

Detailed Description

Definition at line 351 of file SubstructLibrary.h.

Constructor & Destructor Documentation

~KeyHolderBase()

virtual RDKit::KeyHolderBase::~KeyHolderBase ( )

inlinevirtual

Definition at line 353 of file SubstructLibrary.h.

Member Function Documentation

addKey()

virtual unsigned int RDKit::KeyHolderBase::addKey ( const std::string &  )

pure virtual

Add a key to the database, this needs to be in the same order as the molecule, no validation is done

Implemented in RDKit::KeyFromPropHolder.

addMol()

virtual unsigned int RDKit::KeyHolderBase::addMol ( const ROMol &  m )

pure virtual

Add a key to the database getting it from the molecule.

Implemented in RDKit::KeyFromPropHolder.

getKey()

virtual const std::string & RDKit::KeyHolderBase::getKey ( unsigned int  ) const

pure virtual

Implemented in RDKit::KeyFromPropHolder.

getKeys()

virtual std::vector< std::string > RDKit::KeyHolderBase::getKeys ( const std::vector< unsigned int > &  indices ) const

pure virtual

Implemented in RDKit::KeyFromPropHolder.

size()

virtual unsigned int RDKit::KeyHolderBase::size ( ) const

pure virtual

Get the current keeyholder size.

Implemented in RDKit::KeyFromPropHolder.

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

• SubstructLibrary.h