RDKit: RDKit::MolSupplier Class Reference

#include <MolSupplier.h>

Inheritance diagram for RDKit::MolSupplier:

List of all members.

Public Member Functions
	MolSupplier ()
virtual	~MolSupplier ()
virtual void	init ()=0
virtual void	reset ()=0
virtual bool	atEnd ()=0
virtual ROMol *	next ()=0
Protected Attributes
std::istream *	dp_inStream
bool	df_owner

Detailed Description

Here are a couple of ways one can interact with MolSuppliers:

1) Lazy (ForwardIterator): while(!supplier.atEnd()){ ROMol *mol = supplier.next(); if(mol){ do something; } } 2) Random Access: for(int i=0;i<supplier.length();i++){ ROMol *mol = supplier[i]; if(mol){ do something; } }

Definition at line 45 of file MolSupplier.h.

Constructor & Destructor Documentation

RDKit::MolSupplier::MolSupplier ( ) [inline]

Definition at line 48 of file MolSupplier.h.

virtual RDKit::MolSupplier::~MolSupplier ( ) [inline, virtual]

Definition at line 49 of file MolSupplier.h.

Member Function Documentation

virtual bool RDKit::MolSupplier::atEnd ( ) [pure virtual]

Implemented in RDKit::ForwardSDMolSupplier, RDKit::SDMolSupplier, RDKit::SmilesMolSupplier, and RDKit::TDTMolSupplier.

virtual void RDKit::MolSupplier::init ( ) [pure virtual]

Implemented in RDKit::ForwardSDMolSupplier, RDKit::SDMolSupplier, RDKit::SmilesMolSupplier, and RDKit::TDTMolSupplier.

virtual ROMol* RDKit::MolSupplier::next ( ) [pure virtual]

Implemented in RDKit::ForwardSDMolSupplier, RDKit::SDMolSupplier, RDKit::SmilesMolSupplier, and RDKit::TDTMolSupplier.

virtual void RDKit::MolSupplier::reset ( ) [pure virtual]

Implemented in RDKit::ForwardSDMolSupplier, RDKit::SDMolSupplier, RDKit::SmilesMolSupplier, and RDKit::TDTMolSupplier.

Member Data Documentation

bool RDKit::MolSupplier::df_owner [protected]

Definition at line 66 of file MolSupplier.h.

Referenced by RDKit::ForwardSDMolSupplier::~ForwardSDMolSupplier().

std::istream* RDKit::MolSupplier::dp_inStream [protected]

Definition at line 64 of file MolSupplier.h.

Referenced by RDKit::ForwardSDMolSupplier::~ForwardSDMolSupplier().

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

MolSupplier.h