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Identification of diverse database subsets using property-based and fragment-based molecular descriptions

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Figure

Table 3: Property-based k-means selection
Table 5: Numbers of times that each approach was superior to the other
Figure 1:  The Euclidean distance and the Soergel distance.  In the case of continuous attributes, let the molecules A and B be represented by vectors such that xthe total number of distinct attributes) in molecule A (and similarly for molecule B)

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