Toward quantitative estimates of binding affinities for protein–ligand systems involving large inhibitor compounds: A steered molecular dynamics simulation route
Article first published online: 26 APR 2013
Copyright © 2013 Wiley Periodicals, Inc.
Journal of Computational Chemistry
Volume 34, Issue 18, pages 1561–1576, 5 July 2013
How to Cite
How to cite this article: J. Comput. Chem. 2013, 34, 1561–1576. DOI: 10.1002/jcc.23286, , , , ,
- Issue published online: 11 JUN 2013
- Article first published online: 26 APR 2013
- Manuscript Accepted: 5 MAR 2013
- Manuscript Revised: 1 MAR 2013
- Manuscript Received: 22 DEC 2012
- European Union Contract. Grant Number: RII3-CT-2003-506350
- Italian Ministero dell'Istruzione, dell'Università e della Ricerca
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