A partition function-based weighting scheme in force field parameter development using ab initio calculation results in global configurational space
Article first published online: 19 FEB 2013
Copyright © 2013 Wiley Periodicals, Inc.
Journal of Computational Chemistry
Volume 34, Issue 15, pages 1271–1282, 5 June 2013
How to Cite
Wu, Y., Dai, X., Huang, N. and Zhao, L. (2013), A partition function-based weighting scheme in force field parameter development using ab initio calculation results in global configurational space. J. Comput. Chem., 34: 1271–1282. doi: 10.1002/jcc.23249
- Issue published online: 25 APR 2013
- Article first published online: 19 FEB 2013
- Manuscript Accepted: 20 JAN 2013
- Manuscript Revised: 16 JAN 2013
- Manuscript Received: 7 NOV 2012
- National Science Foundation of China. Grant Number: 21003011
- Chinese Ministry of Science Technology “973”. Grant Number: 2011CB812402
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