BLEEP - Potential of mean force describing protein-ligand interactions: II. Calculation of binding energies and comparison with experimental data

Journal of Computational Chemistry

Volumn 20, Issue 11, 1999, Pages 1177-1185

  Mitchell, John B O ^a   Laskowski, Roman A ^b   Alex, Alexander ^c   Forster, Mark J ^d   Thornton, Janet M ^a,b  

^a UNIVERSITY COLLEGE LONDON   (United Kingdom)

^b UNIVERSITY OF LONDON   (United Kingdom)

^c PFIZER GLOBAL RESEARCH AND DEVELOPMENT   (United Kingdom)

^d NATIONAL INSTITUTE FOR BIOLOGICAL STANDARDS AND CONTROL   (United Kingdom)

Author keywords

Computer aided drug design; Knowledge based potential; Potential of mean force; Protein heparin binding; Protein ligand interactions

Indexed keywords

EID: 0000882405     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(199908)20:11<1177::AID-JCC8>3.0.CO;2-0     Document Type: Review

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