Package Pmv :: Module editCommands :: Class ComputeGasteigerGUICommand

Class ComputeGasteigerGUICommand

ViewerFramework.VFCommand.Command --+    
                                    |    
                  mvCommand.MVCommand --+
                                        |
                                       ComputeGasteigerGUICommand

Calls computeGasteiger which does work of computing gasteiger partial charges
for each atom and entering each atom's charge in its _charges dictionary.
    
Package:Pmv
    
Module :editCommands
    
Class:ComputeGasteigerGUICommand
    
Command:computeGasteigerGC
    
Synopsis:
 
        None<---computeGasteigerGC(nodes, **kw)
    
Required Arguments:

        nodes --- TreeNodeSet holding the current selection

Instance Methods

[hide private]

__init__(self, func=None)

onAddCmdToViewer(self)
method called when an instance of this command is added to the viewer.

doit(self, nodes)
virtual method.

__call__(self, nodes, **kw)
None<---computeGasteigerGC(nodes, **kw)

guiCallback(self)

Inherited from mvCommand.MVCommand: strArg

Inherited from mvCommand.MVCommand (private): _strArg

Inherited from ViewerFramework.VFCommand.Command: __repr__, addCallbackAfter, addCallbackBefore, addUndoCall, afterDoit, beforeDoit, buildFormDescr, buildLogArgList, checkDependencies, cleanup, customizeGUI, doitWrapper, getArguments, getHelp, getLastUsedValues, getLogArgs, getValNamedArgs, log, logString, onAddNewCmd, onCmdRun, setLastUsedValues, setupUndoAfter, setupUndoBefore, showForm, tkCb, updateGeom, warningMsg