BALL::VIEW::CharmmConfigurationDialog Class Reference

#include <BALL/VIEW/DIALOGS/charmmConfigurationDialog.h>

Inheritance diagram for BALL::VIEW::CharmmConfigurationDialog:

List of all members.

Public Slots
virtual void	resetOptions ()
void	accept ()
void	reject ()
void	applyTo (CharmmFF &charmm)
	apply the settings to a given CHARMM force field
void	chooseSolventFile ()
void	periodicBoundaryClicked ()
Public Member Functions
	CharmmConfigurationDialog (QWidget *parent=NULL, const char *name="CharmmConfiguration")
	Constructor.
virtual	~CharmmConfigurationDialog ()
	Destructor.
const String &	getFilename () const
Protected Slots
virtual void	browseParameterFiles ()
Protected Member Functions
void	setCharmmFF (CharmmFF &charmm)
Private Member Functions
String	getValue_ (const QCheckBox *box) const
float	getValue_ (const QLineEdit *edit) const throw (Exception::InvalidFormat)
Private Attributes
CharmmFF *	charmm_
Friends
class	MolecularStructure

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Detailed Description

Dialog for changing the options of the CHARMM forcefield

Definition at line 29 of file charmmConfigurationDialog.h.

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Constructor & Destructor Documentation

BALL::VIEW::CharmmConfigurationDialog::CharmmConfigurationDialog	(	QWidget *	parent = NULL,
		const char *	name = "CharmmConfiguration"
	)

Constructor.

virtual BALL::VIEW::CharmmConfigurationDialog::~CharmmConfigurationDialog

(

)

[virtual]

Destructor.

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Member Function Documentation

void BALL::VIEW::CharmmConfigurationDialog::accept

(

)

[slot]

void BALL::VIEW::CharmmConfigurationDialog::applyTo

(

CharmmFF &

charmm

)

[slot]

apply the settings to a given CHARMM force field

virtual void BALL::VIEW::CharmmConfigurationDialog::browseParameterFiles

(

)

[protected, virtual, slot]

void BALL::VIEW::CharmmConfigurationDialog::chooseSolventFile

(

)

[slot]

const String& BALL::VIEW::CharmmConfigurationDialog::getFilename

(

)

const

String BALL::VIEW::CharmmConfigurationDialog::getValue_

(

const QCheckBox *

box

)

const [private]

float BALL::VIEW::CharmmConfigurationDialog::getValue_

(

const QLineEdit *

edit

)

const throw (Exception::InvalidFormat) [private]

void BALL::VIEW::CharmmConfigurationDialog::periodicBoundaryClicked

(

)

[slot]

void BALL::VIEW::CharmmConfigurationDialog::reject

(

)

[slot]

virtual void BALL::VIEW::CharmmConfigurationDialog::resetOptions

(

)

[virtual, slot]

void BALL::VIEW::CharmmConfigurationDialog::setCharmmFF

(

CharmmFF &

charmm

)

[protected]

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Friends And Related Function Documentation

friend class MolecularStructure [friend]

Definition at line 34 of file charmmConfigurationDialog.h.

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Member Data Documentation

CharmmFF* BALL::VIEW::CharmmConfigurationDialog::charmm_ [private]

Definition at line 83 of file charmmConfigurationDialog.h.