De Novo Ligand Design to Partially Flexible Active Sites: Application of the ReFlex Algorithm to Carboxypeptidase A, Acetylcholinesterase, and the Estrogen Receptor

Stuart Firth-Clark, Stewart B. Kirton, Henriƫtte M. G. Willems, Anthony Williams. De Novo Ligand Design to Partially Flexible Active Sites: Application of the ReFlex Algorithm to Carboxypeptidase A, Acetylcholinesterase, and the Estrogen Receptor. Journal of Chemical Information and Computer Sciences, 48(2):296-305, 2008. [doi]

Abstract

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