BALL::VIEW::CharmmConfigurationDialog Class Reference

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

Inheritance diagram for BALL::VIEW::CharmmConfigurationDialog:

Public Slots
virtual void	resetOptions ()
void	accept ()
void	reject ()
void	applyTo (CharmmFF &charmm)
	apply the settings to a given CHARMM force field More...
void	chooseSolventFile ()
void	periodicBoundaryClicked ()

Public Member Functions
	CharmmConfigurationDialog (QWidget *parent=NULL, const char *name="CharmmConfiguration")
	Constructor. More...
virtual	~CharmmConfigurationDialog ()
	Destructor. More...
const String &	getFilename () const
Public Member Functions inherited from BALL::VIEW::PreferencesEntry
	PreferencesEntry ()
virtual	~PreferencesEntry ()
virtual void	writePreferenceEntries (INIFile &inifile)
	Store the settings of all registered objects. More...
virtual void	readPreferenceEntries (const INIFile &inifile)
	Restore the settings of all registered objects. More...
void	setINIFileSectionName (const String &name)
	Set the name for the section in the INIFile. More...
const String &	getINIFileSectionName () const
	Get the name for the section in the INIFile. More...
void	setWidgetStackName (const String &name)
StackPages &	getStackPages ()
	Return all pages, that are to be shown in a parent QStackedWidget. More...
void	setWidgetStack (QStackedWidget *stack)
virtual void	showStackPage (Position nr)
	Show the specified page in the QStackedWidget. More...
virtual void	showStackPage (QWidget *widget)
	Show the specified page in the QStackedWidget. More...
virtual Position	currentStackPage () const
	Get the currently shown page in the QStackedWidget. More...
virtual void	restoreDefaultValues (bool all=false)
	Set all registered objects to their default values. More...
virtual void	storeValues ()
virtual void	restoreValues (bool all=false)
virtual void	dump (std::ostream &s=std::cout, Size depth=0) const

Protected Slots
virtual void	browseParameterFiles ()

Protected Member Functions
void	setCharmmFF (CharmmFF &charmm)
Protected Member Functions inherited from BALL::VIEW::PreferencesEntry
void	registerWidgets_ ()
void	registerObject_ (QObject *widget)
void	unregisterObject_ (QObject *widget)
void	registerWidgetForHelpSystem_ (const QWidget *widget, const String &url)
void	restoreValues_ (bool all, const ValueMap &map)
void	insertStackEntry_ (QWidget *, const String &name)
bool	isSupported_ (QObject &widget)
bool	getValue_ (const QObject *widget, String &value)
bool	setValue_ (QObject *widget, const String &value)

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

Additional Inherited Members
Public Types inherited from BALL::VIEW::PreferencesEntry
typedef std::list< std::pair < QWidget *, String > >	StackPages
Protected Types inherited from BALL::VIEW::PreferencesEntry
typedef HashMap< const QObject *, String >	ValueMap
Protected Attributes inherited from BALL::VIEW::PreferencesEntry
String	inifile_section_name_
HashSet< QObject * >	registered_objects_
ValueMap	default_values_
ValueMap	last_values_
QStackedWidget *	widget_stack_
StackPages	stack_pages_

Detailed Description

Dialog for changing the options of the CHARMM forcefield

Definition at line 29 of file charmmConfigurationDialog.h.

Constructor & Destructor Documentation

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

Constructor.

virtual BALL::VIEW::CharmmConfigurationDialog::~CharmmConfigurationDialog ( )

virtual

Destructor.

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 ( )

protectedvirtualslot

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 ( )

virtualslot

void BALL::VIEW::CharmmConfigurationDialog::setCharmmFF ( CharmmFF &  charmm )

protected

Friends And Related Function Documentation

friend class MolecularStructure

friend

Definition at line 34 of file charmmConfigurationDialog.h.

Member Data Documentation

CharmmFF* BALL::VIEW::CharmmConfigurationDialog::charmm_

private

Definition at line 83 of file charmmConfigurationDialog.h.