RDKit::RGroupGa Class Reference

#include <RGroupGa.h>

Inheritance diagram for RDKit::RGroupGa:

Public Member Functions
	RGroupGa (const RGroupDecompData &rGroupData, const chrono::steady_clock::time_point *const t0=nullptr)
IntegerStringChromosomePolicy &	getChromosomePolicy ()
int	chromosomeLength () const
int	numberDecompositions () const
GaResult	run (int runNumber=1)
vector< GaResult >	runBatch ()
shared_ptr< RGroupDecompositionChromosome >	createChromosome ()
const RGroupDecompData &	getRGroupData () const
const vector< shared_ptr< GaOperation< RGroupDecompositionChromosome > > >	getOperations () const
unsigned int	numberPermutations () const

Detailed Description

Definition at line 103 of file RGroupGa.h.

Constructor & Destructor Documentation

RGroupGa()

RDKit::RGroupGa::RGroupGa	(	const RGroupDecompData &	rGroupData,
		const chrono::steady_clock::time_point *const	t0 = nullptr )

Member Function Documentation

chromosomeLength()

int RDKit::RGroupGa::chromosomeLength ( ) const

inline

Definition at line 112 of file RGroupGa.h.

createChromosome()

shared_ptr< RGroupDecompositionChromosome > RDKit::RGroupGa::createChromosome

(

)

getChromosomePolicy()

IntegerStringChromosomePolicy & RDKit::RGroupGa::getChromosomePolicy ( )

inline

Definition at line 108 of file RGroupGa.h.

getOperations()

const vector< shared_ptr< GaOperation< RGroupDecompositionChromosome > > > RDKit::RGroupGa::getOperations

(

)

const

getRGroupData()

const RGroupDecompData & RDKit::RGroupGa::getRGroupData ( ) const

inline

Definition at line 122 of file RGroupGa.h.

numberDecompositions()

int RDKit::RGroupGa::numberDecompositions ( ) const

inline

Definition at line 114 of file RGroupGa.h.

numberPermutations()

unsigned int RDKit::RGroupGa::numberPermutations ( ) const

inline

Definition at line 127 of file RGroupGa.h.

run()

GaResult RDKit::RGroupGa::run

(

int

runNumber = 1

)

runBatch()

vector< GaResult > RDKit::RGroupGa::runBatch

(

)

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

• RGroupGa.h