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Guanhua Hou, Ph.D.

Affiliations: 
2012 Chemistry University of Wisconsin, Madison, Madison, WI 
Area:
computational chemistry and biophysics
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"Guanhua Hou"
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Qiang Cui grad student 2012 UW Madison
 (QM/MM studies of phosphoryl transfer reactions in Alkaline Phosphatase superfamily.)

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Fang B, Hou G, Zi G, et al. (2015) A thorium metallacyclopentadiene complex: a combined experimental and computational study. Dalton Transactions (Cambridge, England : 2003). 44: 7927-34
Fang B, Zhang L, Hou G, et al. (2015) Experimental and Computational Studies on an Actinide Metallacyclocumulene Complex Organometallics. 34: 5669-5681
Hou G, Cui Q. (2013) Stabilization of different types of transition states in a single enzyme active site: QM/MM analysis of enzymes in the alkaline phosphatase superfamily. Journal of the American Chemical Society. 135: 10457-69
Hou G, Zhu X, Elstner M, et al. (2012) A modified QM/MM Hamiltonian with the Self-Consistent-Charge Density-Functional-Tight-Binding Theory for highly charged QM regions. Journal of Chemical Theory and Computation. 8: 4293-4304
Hou G, Cui Q. (2012) QM/MM analysis suggests that Alkaline Phosphatase (AP) and nucleotide pyrophosphatase/phosphodiesterase slightly tighten the transition state for phosphate diester hydrolysis relative to solution: implication for catalytic promiscuity in the AP superfamily. Journal of the American Chemical Society. 134: 229-46
Riccardi D, Zhu X, Goyal P, et al. (2012) Toward molecular models of proton pumping: Challenges, methods and relevant applications Science China Chemistry. 55: 3-18
Yi C, Jia G, Hou G, et al. (2010) Iron-catalysed oxidation intermediates captured in a DNA repair dioxygenase. Nature. 468: 330-3
Hou G, Zhu X, Cui Q. (2010) An implicit solvent model for SCC-DFTB with Charge-Dependent Radii. Journal of Chemical Theory and Computation. 6: 2303-2314
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