Scaffold Hunter – Interactive Exploration of Chemical Space
Klein, Karsten and Kriege, Nils and Mutzel, Petra and Waldmann, Herbert and Wetzel, Stefan (2010) Scaffold Hunter – Interactive Exploration of Chemical Space. In: Graph Drawing 17th International Symposium, GD 2009, September 22-25, 2009, Chicago, IL, USA , pp. 426-427 (Official URL: http://dx.doi.org/10.1007/978-3-642-11805-0_47).
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Scaffold Hunter is a Java-based software tool for the analysis of structure-related biochemical data. It facilitates the interactive exploration of chemical space by enabling generation of and navigation in a scaffold tree hierarchy annotated with various data. The graphical visualization of structural relationships allows to analyze large data sets, e.g., to correlate chemical structure and biochemical activity.
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