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Analysis of neighborhood behavior in lead optimization and array design.
Papadatos G, Cooper AW, Kadirkamanathan V, Macdonald SJ, McLay IM, Pickett SD, Pritchard JM, Willett P, Gillet VJ. Papadatos G, et al. Among authors: gillet vj. J Chem Inf Model. 2009 Feb;49(2):195-208. doi: 10.1021/ci800302g. J Chem Inf Model. 2009. PMID: 19434823
Designing focused libraries using MoSELECT.
Gillet VJ, Willett P, Fleming PJ, Green DV. Gillet VJ, et al. J Mol Graph Model. 2002 Jun;20(6):491-8. doi: 10.1016/s1093-3263(01)00150-4. J Mol Graph Model. 2002. PMID: 12071283 Free article.
Similarity searching using reduced graphs.
Gillet VJ, Willett P, Bradshaw J. Gillet VJ, et al. J Chem Inf Comput Sci. 2003 Mar-Apr;43(2):338-45. doi: 10.1021/ci025592e. J Chem Inf Comput Sci. 2003. PMID: 12653495
58 results