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Projected hybrid orbitals: a general QM/MM method.
Wang Y, Gao J. Wang Y, et al. J Phys Chem B. 2015 Jan 22;119(3):1213-24. doi: 10.1021/jp507983u. Epub 2014 Oct 15. J Phys Chem B. 2015. PMID: 25317748 Free PMC article.
Kinetic isotope effects of L-Dopa decarboxylase.
Lin YL, Gao J. Lin YL, et al. J Am Chem Soc. 2011 Mar 30;133(12):4398-403. doi: 10.1021/ja108209w. Epub 2011 Mar 2. J Am Chem Soc. 2011. PMID: 21366322 Free PMC article.
27 results