Clustering for 2D chemical structures

The clustering of chemical structures is important and widely used in several areas of chemoinformatics. A little-discussed aspect of clustering is standardization, it ensures all descriptors in a chemical representation make a comparable contribution to the measurement of similarity. The initial st...

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Bibliographic Details
Main Author: Chu, Chia-Wei
Published: University of Sheffield 2011
Subjects:
541
Online Access:http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.531140