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/ . / ViewDock / Compound.py / Results
Class for holding information about a set of DOCK results
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Methods
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setSortKey
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setSortKey (
self,
k,
dir=None,
)
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hideDeleted
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hideDeleted ( self )
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setSelected
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setSelected ( self, selected )
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mordorHidden
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mordorHidden ( self, compound )
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displayDeleted
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displayDeleted ( self )
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updateDisplayedCompounds
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updateDisplayedCompounds ( self )
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mordorDefTemplate
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mordorDefTemplate ( self )
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__init__
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__init__ (
self,
filename,
filetype,
notifySelectionChange,
notifyCompoundChange,
sessionData,
)
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Exceptions
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chimera.UserError( "no models found in file %s!" % filename )
chimera.UserError( "file %s does not appear to be" " DOCK output" % filename )
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displayAll
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displayAll ( self )
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mordorCloseCB
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mordorCloseCB ( self, compound )
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hidePurged
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hidePurged ( self )
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mordorShown
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mordorShown ( self, compound )
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updateCompounds
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updateCompounds (
self,
show,
filterSet,
)
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mordorRemakeMenu
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mordorRemakeMenu ( self )
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deleteColumn
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deleteColumn ( self, col )
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save
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save (
self,
filename=None,
skipPurged=0,
)
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setSelectedState
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setSelectedState ( self, state )
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mordorSetMenubar
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mordorSetMenubar ( self, menubar )
Mordor format menu callbacks
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pruneModels
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pruneModels ( self, molList )
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movieSetup
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movieSetup ( self )
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displayPurged
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displayPurged ( self )
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mordorApplyTemplates
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mordorApplyTemplates ( self, name )
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saveSession
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saveSession ( self )
Return printable representation of data
Session methods
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movieStop
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movieStop ( self )
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setCompoundsFrame
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setCompoundsFrame ( self, frame )
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movieStep
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movieStep ( self )
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selectModels
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selectModels ( self, molList )
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invertSelected
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invertSelected ( self )
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setCompoundsKeys
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setCompoundsKeys ( self, keys )
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getColumns
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getColumns ( self )
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mordorClose
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mordorClose ( self, compound )
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updateSelectedCompounds
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updateSelectedCompounds ( self, event=None )
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restoreSession
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restoreSession ( self, data )
Convert session string back into data
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displayViable
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displayViable ( self )
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hideViable
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hideViable ( self )
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createColumn
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createColumn (
self,
col,
style,
replacing=None,
)
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addColumn
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addColumn ( self, col )
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mordorDelTemplate
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mordorDelTemplate ( self )
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