Package schrodinger :: Package application :: Package jaguar :: Package gui :: Module basis_selector :: Class BasisSelectorLineEdit

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Class BasisSelectorLineEdit

                                object --+        
                                         |        
ui.qt.pop_up_widgets._WidgetWithPopUpMixin --+    
                                             |    
                     PyQt4.QtGui.QLineEdit --+    
                                             |    
        ui.qt.pop_up_widgets.LineEditWithPopUp --+
                                                 |
                                                BasisSelectorLineEdit

A line edit that can be used to select a basis set. A basis selector pop up will appear whenever this line edit has focus.

Instance Methods

[hide private]

__init__(self, parent)
x.__init__(...) initializes x; see help(type(x)) for signature

setBlankBasisAllowed(self, allowed)
Specify whether a blank basis set is allowed or should result in an "Invalid basis set" warning and a red outline around the line edit.

_setUpCompleter(self)
Create a completer that will suggest valid basis set names

textUpdated(self, text)
Whenever the text in the line edit is changed, update the pop up and the red error outline

_updateBorder(self)
If the user has specified an invalid basis set, draw a red outline around the line edit.

popUpUpdated(self, basis_name)
Whenever the basis selected in the pop up is changed, update the line edit.

setStructure(self, struc)
Set the structure to use for determining basis set information and availability

setAtomNum(self, atom_num)
Set the atom number.

setPerAtom(self, per_atom)
Set the atom number.

setBasis(self, basis)
Set the basis to the requested value.

hasAcceptableInput(self)
Return True if a basis set has been specified.

isValid(self)
Return True if a basis set has been specified and the basis set applies to the current structure.

Inherited from ui.qt.pop_up_widgets.LineEditWithPopUp: focusInEvent, mousePressEvent

Inherited from ui.qt.pop_up_widgets._WidgetWithPopUpMixin: baseSetup, moveEvent, resizeEvent, setPopupHalign, setPopupValign, showEvent

Inherited from ui.qt.pop_up_widgets._WidgetWithPopUpMixin (private): _autoPopupAlignment, _getPopupAlignment, _setPopUpGeometry

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

Instance Variables

[hide private]

Inherited from ui.qt.pop_up_widgets.LineEditWithPopUp: popUpClosing

Inherited from ui.qt.pop_up_widgets.LineEditWithPopUp (private): _pop_up

Properties

[hide private]

Inherited from object: __class__

Method Details

[hide private]

init(self, parent)
(Constructor)

x.__init__(...) initializes x; see help(type(x)) for signature

Parameters:

parent - The Qt parent widget
pop_up_class - The class of the pop up widget. Should be a subclass of PopUp.

Overrides: object.__init__

(inherited documentation)

setBlankBasisAllowed(self, allowed)

Specify whether a blank basis set is allowed or should result in an "Invalid basis set" warning and a red outline around the line edit.

Parameters:

allowed (bool) - True if a blank basis set should be allowed. False if a blank basis set should result in a warning.

textUpdated(self, text)

Whenever the text in the line edit is changed, update the pop up and the red error outline

Parameters:

text (str) - The current text in the line edit

Overrides: ui.qt.pop_up_widgets.LineEditWithPopUp.textUpdated

_updateBorder(self)

If the user has specified an invalid basis set, draw a red outline around the line edit. If the user has specified a valid basis set, set the outline back to normal.

popUpUpdated(self, basis_name)

Whenever the basis selected in the pop up is changed, update the line edit.

Parameters:

basis_name (str) - The basis selected in the pop up

Overrides: ui.qt.pop_up_widgets._WidgetWithPopUpMixin.popUpUpdated

setStructure(self, struc)

Set the structure to use for determining basis set information and availability

Parameters:

struc (schrodinger.structure.Structure) - The structure to use

setAtomNum(self, atom_num)

Set the atom number. The basis selector will now allow the user to select a basis set for the specified atom rather than for the entire structure. Note that this function will clear any per-atom basis sets that have been set via setPerAtom.

Parameters:

atom_num (int) - The atom index

setPerAtom(self, per_atom)

Parameters:

atom_num (int) - The atom index

setBasis(self, basis)

Set the basis to the requested value.

Parameters:

basis_full (str or NoneType) - The requested basis. Note that this name may include *'s and +'s.

Raises:

ValueError - If the requested basis was not valid. In these cases, the basis set will not be changed.

hasAcceptableInput(self)

Return True if a basis set has been specified. False otherwise.

isValid(self)

Return True if a basis set has been specified and the basis set applies to the current structure. False otherwise.

Class BasisSelectorLineEdit

__init__(self, parent) (Constructor)

setBlankBasisAllowed(self, allowed)

textUpdated(self, text)

_updateBorder(self)

popUpUpdated(self, basis_name)

setStructure(self, struc)

setAtomNum(self, atom_num)

setPerAtom(self, per_atom)

setBasis(self, basis)

hasAcceptableInput(self)

isValid(self)

init(self, parent)
(Constructor)