CDPL::Chem::PatternAtomTyper Class Reference

PatternAtomTyper. More...

#include <PatternAtomTyper.hpp>

Classes
class	Pattern

Public Types
typedef std::shared_ptr< PatternAtomTyper >	SharedPointer
typedef PatternList::const_iterator	ConstPatternIterator
typedef PatternList::iterator	PatternIterator

Public Member Functions
	PatternAtomTyper ()
	PatternAtomTyper (const PatternAtomTyper &typer)
void	addPattern (const MolecularGraph::SharedPointer &structure, std::size_t atom_label=0, std::size_t priority=0, bool all_matches=true, bool unique_matches=false)
void	addPattern (const Pattern &ptn)
const Pattern &	getPattern (std::size_t idx) const
void	removePattern (std::size_t idx)
void	removePattern (const PatternIterator &ptn_it)
void	clear ()
std::size_t	getNumPatterns () const
ConstPatternIterator	getPatternsBegin () const
ConstPatternIterator	getPatternsEnd () const
PatternIterator	getPatternsBegin ()
PatternIterator	getPatternsEnd ()
ConstPatternIterator	begin () const
ConstPatternIterator	end () const
PatternIterator	begin ()
PatternIterator	end ()
bool	hasAtomLabel (std::size_t idx) const
std::size_t	getAtomLabel (std::size_t idx) const
std::size_t	getPatternIndex (std::size_t idx) const
void	execute (const MolecularGraph &molgraph)
PatternAtomTyper &	operator= (const PatternAtomTyper &typer)

Detailed Description

PatternAtomTyper.

Member Typedef Documentation

SharedPointer

typedef std::shared_ptr<PatternAtomTyper> CDPL::Chem::PatternAtomTyper::SharedPointer

ConstPatternIterator

typedef PatternList::const_iterator CDPL::Chem::PatternAtomTyper::ConstPatternIterator

PatternIterator

typedef PatternList::iterator CDPL::Chem::PatternAtomTyper::PatternIterator

Constructor & Destructor Documentation

PatternAtomTyper() [1/2]

CDPL::Chem::PatternAtomTyper::PatternAtomTyper

(

)

PatternAtomTyper() [2/2]

CDPL::Chem::PatternAtomTyper::PatternAtomTyper

(

const PatternAtomTyper &

typer

)

Member Function Documentation

addPattern() [1/2]

void CDPL::Chem::PatternAtomTyper::addPattern	(	const MolecularGraph::SharedPointer &	structure,
		std::size_t	atom_label = 0,
		std::size_t	priority = 0,
		bool	all_matches = true,
		bool	unique_matches = false
	)

addPattern() [2/2]

void CDPL::Chem::PatternAtomTyper::addPattern

(

const Pattern &

ptn

)

getPattern()

const Pattern& CDPL::Chem::PatternAtomTyper::getPattern

(

std::size_t

idx

)

const

removePattern() [1/2]

void CDPL::Chem::PatternAtomTyper::removePattern

(

std::size_t

idx

)

removePattern() [2/2]

void CDPL::Chem::PatternAtomTyper::removePattern

(

const PatternIterator &

ptn_it

)

clear()

void CDPL::Chem::PatternAtomTyper::clear

(

)

getNumPatterns()

std::size_t CDPL::Chem::PatternAtomTyper::getNumPatterns

(

)

const

getPatternsBegin() [1/2]

ConstPatternIterator CDPL::Chem::PatternAtomTyper::getPatternsBegin

(

)

const

getPatternsEnd() [1/2]

ConstPatternIterator CDPL::Chem::PatternAtomTyper::getPatternsEnd

(

)

const

getPatternsBegin() [2/2]

PatternIterator CDPL::Chem::PatternAtomTyper::getPatternsBegin

(

)

getPatternsEnd() [2/2]

PatternIterator CDPL::Chem::PatternAtomTyper::getPatternsEnd

(

)

begin() [1/2]

ConstPatternIterator CDPL::Chem::PatternAtomTyper::begin

(

)

const

end() [1/2]

ConstPatternIterator CDPL::Chem::PatternAtomTyper::end

(

)

const

begin() [2/2]

PatternIterator CDPL::Chem::PatternAtomTyper::begin

(

)

end() [2/2]

PatternIterator CDPL::Chem::PatternAtomTyper::end

(

)

hasAtomLabel()

bool CDPL::Chem::PatternAtomTyper::hasAtomLabel

(

std::size_t

idx

)

const

getAtomLabel()

std::size_t CDPL::Chem::PatternAtomTyper::getAtomLabel

(

std::size_t

idx

)

const

getPatternIndex()

std::size_t CDPL::Chem::PatternAtomTyper::getPatternIndex

(

std::size_t

idx

)

const

execute()

void CDPL::Chem::PatternAtomTyper::execute

(

const MolecularGraph &

molgraph

)

operator=()

PatternAtomTyper& CDPL::Chem::PatternAtomTyper::operator=

(

const PatternAtomTyper &

typer

)

---

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

• PatternAtomTyper.hpp