This work is dedicated to Prof. Sigrid Peyerimhoff on occasion of her 75th birthday.
Fully ab initio protein-ligand interaction energies with dispersion corrected density functional theory†
Article first published online: 9 MAY 2012
Copyright © 2012 Wiley Periodicals, Inc.
Journal of Computational Chemistry
Volume 33, Issue 21, pages 1730–1739, 5 August 2012
How to Cite
Antony, J. and Grimme, S. (2012), Fully ab initio protein-ligand interaction energies with dispersion corrected density functional theory. J. Comput. Chem., 33: 1730–1739. doi: 10.1002/jcc.23004
- Issue published online: 15 JUN 2012
- Article first published online: 9 MAY 2012
- Manuscript Accepted: 11 APR 2012
- Manuscript Revised: 10 APR 2012
- Manuscript Received: 12 JAN 2012
- German Research Foundation. Grant Number: AN 793/1-1
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