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2016-4 Schrodinger Python API
Package schrodinger :: Package application :: Package jaguar :: Package gui :: Module theory_tab_widgets :: Class ExcitedStateWidget
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Class ExcitedStateWidget

       object --+                
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sip.simplewrapper --+            
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          sip.wrapper --+        
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     PyQt4.QtCore.QObject --+    
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           object --+       |    
                    |       |    
    sip.simplewrapper --+   |    
                        |   |    
 PyQt4.QtGui.QPaintDevice --+    
                            |    
          PyQt4.QtGui.QWidget --+
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                               ExcitedStateWidget
Known Subclasses:

This widget allows user to specify 'Excited state' options.

Nested Classes [hide private]

Inherited from PyQt4.QtGui.QWidget: RenderFlag, RenderFlags

Inherited from PyQt4.QtGui.QPaintDevice: PaintDeviceMetric

Instance Methods [hide private]
 
__init__(self, parent)
Initialize widget.
 
populateExcitedStatesType(self, es_types)
This function is called to populate combo box that contains excited states types.
 
enableExcitedStatesType(self, enable)
This function is used to enable/disable combo box that defines excited states type and its label.
bool
getExcitedState(self)
Return whether excited state check box is checked or not
 
enableExcitedState(self, enable)
This function is used to enable/disable TDDFT check box and excited state combo box.
dict
getMmJagKeywords(self)
This function returns dictionary of mmjag keywords for this widget.
 
loadSettings(self, jag_input)
Restore Excited state settings from Jaguar handle.
 
setExcitedStateCheckBoxText(self, txt)
Set text for the excited state check box widget.

Inherited from PyQt4.QtGui.QWidget: acceptDrops, accessibleDescription, accessibleName, actionEvent, actions, activateWindow, addAction, addActions, adjustSize, autoFillBackground, backgroundRole, baseSize, changeEvent, childAt, childrenRect, childrenRegion, clearFocus, clearMask, close, closeEvent, contentsMargins, contentsRect, contextMenuEvent, contextMenuPolicy, create, cursor, customContextMenuRequested, destroy, devType, dragEnterEvent, dragLeaveEvent, dragMoveEvent, dropEvent, effectiveWinId, enabledChange, ensurePolished, enterEvent, event, find, focusInEvent, focusNextChild, focusNextPrevChild, focusOutEvent, focusPolicy, focusPreviousChild, focusProxy, focusWidget, font, fontChange, fontInfo, fontMetrics, foregroundRole, frameGeometry, frameSize, geometry, getContentsMargins, grabGesture, grabKeyboard, grabMouse, grabShortcut, graphicsEffect, graphicsProxyWidget, handle, hasFocus, hasMouseTracking, height, heightForWidth, hide, hideEvent, inputContext, inputMethodEvent, inputMethodHints, inputMethodQuery, insertAction, insertActions, isActiveWindow, isAncestorOf, isEnabled, isEnabledTo, isEnabledToTLW, isFullScreen, isHidden, isLeftToRight, isMaximized, isMinimized, isModal, isRightToLeft, isTopLevel, isVisible, isVisibleTo, isWindow, isWindowModified, keyPressEvent, keyReleaseEvent, keyboardGrabber, languageChange, layout, layoutDirection, leaveEvent, locale, lower, mapFrom, mapFromGlobal, mapFromParent, mapTo, mapToGlobal, mapToParent, mask, maximumHeight, maximumSize, maximumWidth, metric, minimumHeight, minimumSize, minimumSizeHint, minimumWidth, mouseDoubleClickEvent, mouseGrabber, mouseMoveEvent, mousePressEvent, mouseReleaseEvent, move, moveEvent, nativeParentWidget, nextInFocusChain, normalGeometry, overrideWindowFlags, overrideWindowState, paintEngine, paintEvent, palette, paletteChange, parentWidget, pos, previousInFocusChain, raise_, rect, releaseKeyboard, releaseMouse, releaseShortcut, removeAction, render, repaint, resetInputContext, resize, resizeEvent, restoreGeometry, saveGeometry, scroll, setAcceptDrops, setAccessibleDescription, setAccessibleName, setAttribute, setAutoFillBackground, setBackgroundRole, setBaseSize, setContentsMargins, setContextMenuPolicy, setCursor, setDisabled, setEnabled, setFixedHeight, setFixedSize, setFixedWidth, setFocus, setFocusPolicy, setFocusProxy, setFont, setForegroundRole, setGeometry, setGraphicsEffect, setHidden, setInputContext, setInputMethodHints, setLayout, setLayoutDirection, setLocale, setMask, setMaximumHeight, setMaximumSize, setMaximumWidth, setMinimumHeight, setMinimumSize, setMinimumWidth, setMouseTracking, setPalette, setParent, setShortcutAutoRepeat, setShortcutEnabled, setShown, setSizeIncrement, setSizePolicy, setStatusTip, setStyle, setStyleSheet, setTabOrder, setToolTip, setUpdatesEnabled, setVisible, setWhatsThis, setWindowFilePath, setWindowFlags, setWindowIcon, setWindowIconText, setWindowModality, setWindowModified, setWindowOpacity, setWindowRole, setWindowState, setWindowTitle, show, showEvent, showFullScreen, showMaximized, showMinimized, showNormal, size, sizeHint, sizeIncrement, sizePolicy, stackUnder, statusTip, style, styleSheet, tabletEvent, testAttribute, toolTip, topLevelWidget, underMouse, ungrabGesture, unsetCursor, unsetLayoutDirection, unsetLocale, update, updateGeometry, updateMicroFocus, updatesEnabled, visibleRegion, whatsThis, wheelEvent, width, winId, window, windowActivationChange, windowFilePath, windowFlags, windowIcon, windowIconText, windowModality, windowOpacity, windowRole, windowState, windowTitle, windowType, x, x11Info, x11PictureHandle, y

Inherited from PyQt4.QtCore.QObject: __getattr__, blockSignals, childEvent, children, connect, connectNotify, customEvent, deleteLater, destroyed, disconnect, disconnectNotify, dumpObjectInfo, dumpObjectTree, dynamicPropertyNames, emit, eventFilter, findChild, findChildren, inherits, installEventFilter, isWidgetType, killTimer, metaObject, moveToThread, objectName, parent, property, pyqtConfigure, receivers, removeEventFilter, sender, senderSignalIndex, setObjectName, setProperty, signalsBlocked, startTimer, thread, timerEvent, tr, trUtf8

Inherited from PyQt4.QtGui.QPaintDevice: colorCount, depth, heightMM, logicalDpiX, logicalDpiY, numColors, paintingActive, physicalDpiX, physicalDpiY, widthMM

Inherited from sip.simplewrapper: __new__

Inherited from object: __delattr__, __format__, __getattribute__, __hash__, __reduce__, __reduce_ex__, __repr__, __setattr__, __sizeof__, __str__, __subclasshook__

Class Variables [hide private]
  CALCULATION_MODE = OrderedDict([('Full linear response', 0), (...

Inherited from PyQt4.QtGui.QWidget: DrawChildren, DrawWindowBackground, IgnoreMask

Inherited from PyQt4.QtCore.QObject: staticMetaObject

Inherited from PyQt4.QtGui.QPaintDevice: PdmDepth, PdmDpiX, PdmDpiY, PdmHeight, PdmHeightMM, PdmNumColors, PdmPhysicalDpiX, PdmPhysicalDpiY, PdmWidth, PdmWidthMM

Instance Variables [hide private]
 
excited_state_changed(...)
A signal indicating that the state of the 'Excited state' toggle has changed.
Properties [hide private]

Inherited from object: __class__

Method Details [hide private]

__init__(self, parent)
(Constructor)

 

Initialize widget.

Parameters:
  • parent (QtCore.QObject) - parent of this dialog.
Overrides: object.__init__

populateExcitedStatesType(self, es_types)

 

This function is called to populate combo box that contains excited states types.

Parameters:
  • es_types (collections.OrderedDict) - dictionary that contains names of excited states types and corresponding mmjag keywords.

enableExcitedStatesType(self, enable)

 

This function is used to enable/disable combo box that defines excited states type and its label.

Parameters:
  • enable (bool) - True or False to enable or disable widgets

getExcitedState(self)

 

Return whether excited state check box is checked or not

Returns: bool
state of excited state check box

enableExcitedState(self, enable)

 

This function is used to enable/disable TDDFT check box and excited state combo box. When TDDFT check box is disabled it will also get unchecked.

Parameters:
  • enable (bool) - True or False to enable or disable widgets

getMmJagKeywords(self)

 

This function returns dictionary of mmjag keywords for this widget.

Returns: dict
mmjag keywords dictionary

loadSettings(self, jag_input)

 

Restore Excited state settings from Jaguar handle.

Parameters:

setExcitedStateCheckBoxText(self, txt)

 

Set text for the excited state check box widget. This method is needed since we want to show different text in the Optimization task.

Parameters:
  • txt (str) - excited state check box text

Class Variable Details [hide private]

CALCULATION_MODE

Value:
OrderedDict([('Full linear response', 0), ('Tamm-Dancoff approximation\
', 1)])

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2016-4 Schrodinger Python API
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