BALL::Result::ResultData Class Reference

#include <BALL/DOCKING/COMMON/result.h>

Public Member Functions
	ResultData ()
	ResultData (int result_type)
void	setReceptorConformationId (String id)
void	setReceptorConformation (Conformation *conf)
bool	hasReceptorConformationId () const
String	getReceptorConformationId () const
void	setLigandConformationId (String id)
void	setLigandConformation (Conformation *conf)
String	getLigandConformationId () const
bool	hasLigandConformationId () const
void	setScoringMethod (int method)
bool	hasScoringMethod () const
int	getScoringMethod () const
void	setEnergy (double e)
double	getEnergy () const
bool	hasEnergy () const
bool	check () const
void	setConformation (Conformation *conf)
Conformation *	getConformation ()

Detailed Description

Definition at line 37 of file result.h.

Constructor & Destructor Documentation

ResultData() [1/2]

BALL::Result::ResultData::ResultData

(

)

ResultData() [2/2]

BALL::Result::ResultData::ResultData

(

int

result_type

)

Member Function Documentation

check()

bool BALL::Result::ResultData::check

(

)

const

getConformation()

Conformation * BALL::Result::ResultData::getConformation

(

)

getEnergy()

double BALL::Result::ResultData::getEnergy

(

)

const

getLigandConformationId()

String BALL::Result::ResultData::getLigandConformationId

(

)

const

getReceptorConformationId()

String BALL::Result::ResultData::getReceptorConformationId

(

)

const

getScoringMethod()

int BALL::Result::ResultData::getScoringMethod

(

)

const

hasEnergy()

bool BALL::Result::ResultData::hasEnergy

(

)

const

hasLigandConformationId()

bool BALL::Result::ResultData::hasLigandConformationId

(

)

const

hasReceptorConformationId()

bool BALL::Result::ResultData::hasReceptorConformationId

(

)

const

hasScoringMethod()

bool BALL::Result::ResultData::hasScoringMethod

(

)

const

setConformation()

void BALL::Result::ResultData::setConformation

(

Conformation *

conf

)

setEnergy()

void BALL::Result::ResultData::setEnergy

(

double

e

)

setLigandConformation()

void BALL::Result::ResultData::setLigandConformation

(

Conformation *

conf

)

setLigandConformationId()

void BALL::Result::ResultData::setLigandConformationId

(

String

id

)

setReceptorConformation()

void BALL::Result::ResultData::setReceptorConformation

(

Conformation *

conf

)

setReceptorConformationId()

void BALL::Result::ResultData::setReceptorConformationId

(

String

id

)

setScoringMethod()

void BALL::Result::ResultData::setScoringMethod

(

int

method

)