Package chemaxon.clustering

Provides classes for clustering.

See:
          Description

Class Summary
Common Common superclass for JKlustor tools.
Compare Compares two sets of objects (like compound libraries) using diversity and dissimilarity calculations.
JarvisPatrick Performs variable-length Jarvis-Patrick clustering based on binary fingerprints (bits strings) and/or other data stored in a database table or a file.
LibraryMCS The LibraryMCS class computes the maximum common substructure (MCS) of a set of compounds.
NearestNeighbors Compares two sets of objects (like compound libraries) using diversity and dissimilarity calculations.
Ward Uses Ward's minimum variance method for clustering molecules based on molecular fingerprints or other descriptors.
 

Package chemaxon.clustering Description

Provides classes for clustering.