Jingzhi Pu

Tests of second-generation and third-generation density functionals for thermochemical kineticsElectronic supplementary information (ESI) available: Mean errors for pure and hybrid DFT methods. See http://www.rsc.org/suppdata/cp/b3/b316260e/

Yan Zhao, Jingzhi Pu, Benjamin J. Lynch et al. · Physical Chemistry Chemical Physics · 2004 · 265 citations

Hybrid Dft, Third-generation Density Functionals, Engineering +15

Generalized Hybrid Orbital (GHO) Method for Combining Ab Initio Hartree−Fock Wave Functions with Molecular Mechanics

Jingzhi Pu, Jiali Gao, Donald G. Truhlar · The Journal of Physical Chemistry A · 2004 · 144 citations

Engineering, Computational Chemistry, Atomic Orbitals +16

How subunit coupling produces the γ-subunit rotary motion in F ₁ -ATPase

Jingzhi Pu, Martin Karplus · Proceedings of the National Academy of Sciences · 2008 · 124 citations · Full text

Catalytic Beta-subunits Act, Single Molecule Biophysics, Biochemistry +14

Small Temperature Dependence of the Kinetic Isotope Effect for the Hydride Transfer Reaction Catalyzed by <i>Escherichia</i> <i>c</i><i>oli</i> Dihydrofolate Reductase

Jingzhi Pu, Shuhua Ma, Jiali Gao et al. · The Journal of Physical Chemistry B · 2005 · 115 citations

Development of a Polarizable Intermolecular Potential Function (PIPF) for Liquid Amides and Alkanes

Wangshen Xie, Jingzhi Pu, Alexander D. MacKerell et al. · Journal of Chemical Theory and Computation · 2007 · 114 citations · Full text