How to cite this article: J. Dziedzic, S. J. Fox,T. Fox, C. S.Tautermann, C.-K. Skylaris, Int. J.Quantum Chem. 2012
Large-scale DFT calculations in implicit solvent—A case study on the T4 lysozyme L99A/M102Q protein†
Article first published online: 28 MAR 2012
Copyright © 2012 Wiley Periodicals, Inc.
International Journal of Quantum Chemistry
Special Issue: 14th International Density Functional Theory Conference
Volume 113, Issue 6, pages 771–785, 15 March 2013
How to Cite
Dziedzic, J., Fox, S. J., Fox, T., Tautermann, C. S. and Skylaris, C.-K. (2013), Large-scale DFT calculations in implicit solvent—A case study on the T4 lysozyme L99A/M102Q protein. Int. J. Quantum Chem., 113: 771–785. doi: 10.1002/qua.24075
- Issue published online: 6 FEB 2013
- Article first published online: 28 MAR 2012
- Manuscript Accepted: 10 FEB 2012
- Manuscript Revised: 7 FEB 2012
- Manuscript Received: 15 DEC 2011
- Engineering and Physical Sciences Research Council. Grant Number: EP/G-55882/1
- Polish Ministry of Science and Information Technology. Grant Number: N N519 577838
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