Clustering of chemical structures

Downs GM, Willett P. Clustering of chemical structure databases for compound selection. In van de Waterbeemd H, editor, Advanced computer-assisted techniques in drug discovery. Weinheim VCH Verlag, 1994. p. 111-30. 

Downs GM, Willett P, Fisanick W, Similarity searching and clustering of chemical-structure databases using molecular property data, J. Chem. Inf. Comput. Sci., 34 1094-1102, 1994. 

H. van de Waterbeemd, Ed., VCH Publishers, Weinheim, 1994, pp. 111—130. Clustering of Chemical Structure Databases for Compound Selection. 

Similarity Searching and Clustering of Chemical-Structure Databases Using Molecular Property Data. 

Willett, P. (1988). Ranking and Clustering of Chemical Structure Databases. In Physical Property Prediction in Organic Chemistry (Jochum, C., Hicks, M.G. and Sunkel, J., eds.), Springer-Ver-lag, Berlin (Germany), pp. 191-207. 

Barnard JM, Downs GM. Clustering of chemical structures on the basis of 2-D similarity measures. J Chem Inf Comput Sci 1992 32 644-649. 

Bawden, D. Browsing and Clustering of Chemical Structures. In these Proceedings. 

G. M. Downs, P. Willett, and W. Fisanidc, /. Chem. Inf. Comput. Set., 34, 1094 (1994). Similarity Searching and Clustering of Chemical-Structure Databases Using Molecular Property Data. 

Bawden D. Browsing and Clustering of Chemical Structures . In Chemical Structures. The International Language of Chemistry Warr W.A., Ed. Springer-Verlag Berlin, 1988 pp. 145-150. 

Similarity and Clustering of Chemical Structure Information Application to the RTECS Database to Explore Structure-activity Relationships for Chemical Toxicity Prediction Walsh, P.T. MSc Thesis, University of Sheffield, 1989. 

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