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Discovery of a Potent CDK2 Inhibitor with a Novel Binding Mode, Using Virtual Screening and Initial, Structure-Guided Lead Scoping

Christine M. Richardson,Claire L. Nunns,Douglas S. Williamson,Martin J. Parratt,Pawel Dokurno,Rob Howes,Jenifer Borgognoni,Martin J. Drysdale,Harry Finch,Roderick E. Hubbard,Philip S. Jackson,Peter Kierstan,Georg Lentzen,Jonathan D. Moore,James B. Murray,Heather Simmonite,Allan E. Surgenor,Christopher J. Torrance

Bioorganic & Medicinal Chemistry Letters（2007）

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关键词
virtual screening,docking,CDK2,cyclin dependent kinase,X-ray crystallography,structure-guided drug design,fragment based
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