SMoG: de novo design method based on simple, fast, and accurate free energy estimates. 2. Case studies in molecular design

Journal of the American Chemical Society

Volumn 119, Issue 20, 1997, Pages 4608-4617

  DeWitte, Robert S ^a   Ishchenko, Alexey V ^a   Shakhnovich, Eugene I ^a  

^a HARVARD UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; BINDING SITE; COMPUTER PROGRAM; ENERGY; LIGAND BINDING; MOLECULAR MODEL; PROTEIN BINDING; PROTEIN STRUCTURE; STRUCTURE ANALYSIS;

EID: 0031003647     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja963689+     Document Type: Article

References (8)

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5. Pawson, T. Nature 1995, 373, 573-580.
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8. Combs, A. P.; Kapoor, T. M.; Feng, S.; Chen, J. K.; Daude-Snow, L. F.; Schreiber, S. L. J. Am. Chem. Soc. 1996, 118, 287-288.