Package com.actelion.research.chem.docking
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Class Summary Class Description DockingEngine DockingEngine.DockingResult DockingUtils LigandPose ScoringTask -
Enum Summary Enum Description DockingEngine.ScoringFunction applies molecular docking to find the binding pose of a ligand molecule into the binding site of the protein nativeLigand: defines the location of the binding site this class is not thread safe! every thread requires it's own instance -
Exception Summary Exception Description DockingFailedException