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Ming Lei
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Study of the properties of molecularly imprinted polymers by computational and conformational analysis
Y Liu, F Wang, T Tan, M Lei
Analytica chimica acta 581 (1), 137-146, 2007
882007
Why is Leu55→ Pro55 transthyretin variant the most amyloidogenic: insights from molecular dynamics simulations of transthyretin monomers
M Yang, M Lei, S Huo
Protein science 12 (6), 1222-1231, 2003
582003
The nature of hydrogen production from aqueous‐phase methanol dehydrogenation with ruthenium pincer complexes under mild conditions
M Lei, Y Pan, X Ma
European Journal of Inorganic Chemistry 2015 (5), 794-803, 2015
572015
Toward understanding metal-binding specificity of porphyrin: a conceptual density functional theory study
XT Feng, JG Yu, M Lei, WH Fang, S Liu
The Journal of Physical Chemistry B 113 (40), 13381-13389, 2009
482009
Dynamics and cooperativity of Trp-cage folding
Z Hu, Y Tang, H Wang, X Zhang, M Lei
Archives of biochemistry and biophysics 475 (2), 140-147, 2008
422008
Mechanistic Investigations on Thermal Hydrogenation of CO2 to Methanol by Nanostructured CeO2(100): The Crystal-Plane Effect on Catalytic Reactivity
W Zhang, XL Ma, H Xiao, M Lei, J Li
The Journal of Physical Chemistry C 123 (18), 11763-11771, 2019
392019
Origins of enantioselectivity in asymmetric ketone hydrogenation catalyzed by a RuH 2 (binap)(cydn) complex: insights from a computational study
R Feng, A Xiao, X Zhang, Y Tang, M Lei
Dalton Transactions 42 (6), 2130-2145, 2013
352013
Initial conformational changes of human transthyretin under partially denaturing conditions
M Yang, M Lei, R Bruschweiler, S Huo
Biophysical journal 89 (1), 433-443, 2005
342005
A novel quantum Monte Carlo strategy: Surplus function approach
H Huang, Q Xie, Z Cao, Z Li, Z Yue, L Ming
The Journal of chemical physics 110 (8), 3703-3707, 1999
331999
A Hydride-Shuttle Mechanism for the Catalytic Hydroboration of CO2
L Li, H Zhu, L Liu, D Song, M Lei
Inorganic Chemistry 57 (6), 3054-3060, 2018
322018
Mechanistic insights into the directed hydrogenation of hydroxylated alkene catalyzed by bis (phosphine) cobalt dialkyl complexes
X Ma, M Lei
The Journal of Organic Chemistry 82 (5), 2703-2712, 2017
322017
Preference of H2 as Hydrogen Source in Hydrogenation of Ketones Catalyzed by Late Transition Metal Complexes. A DFT Study
M Lei, W Zhang, Y Chen, Y Tang
Organometallics 29 (3), 543-548, 2010
312010
Nature of asynchronous hydrogen transfer in ketone hydrogenation catalyzed by Ru complex
Y Chen, S Liu, M Lei
The Journal of Physical Chemistry C 112 (35), 13524-13527, 2008
312008
Access to Polycyclic Sulfonyl Indolines via Fe (II)-Catalyzed or UV-Driven Formal [2+ 2+ 1] Cyclization Reactions of N-((1H-Indol-3-yl) methyl) propiolamides with NaHSO3
L Lu, C Luo, H Peng, H Jiang, M Lei, B Yin
Organic letters 21 (8), 2602-2605, 2019
292019
Mechanism investigation of ketone hydrogenation catalyzed by ruthenium bifunctional catalysts: insights from a DFT study
X Zhang, X Guo, Y Chen, Y Tang, M Lei, W Fang
Physical Chemistry Chemical Physics 14 (17), 6003-6012, 2012
282012
A theoretical study of X ligand effect on catalytic activity of complexes RuHX (diamine)(PPh3) 2 (X= NCMe, CO, Cl, OMe, OPh, CCMe and H) in H 2-hydrogenation of ketones
Z Chen, Y Chen, Y Tang, M Lei
Dalton Transactions 39 (8), 2036-2043, 2010
282010
Metal–Substrate Cooperation Mechanism for Dehydrogenative Amidation Catalyzed by a PNN-Ru Catalyst
L Li, M Lei, L Liu, Y Xie, HF Schaefer III
Inorganic chemistry 57 (15), 8778-8787, 2018
272018
DFT Study on the Mechanism of Tandem Oxidative Acetoxylation/Ortho C–H Activation/Carbocyclization Catalyzed by Pd(OAc)2
H Li, X Ma, B Zhang, M Lei
Organometallics 35 (19), 3301-3310, 2016
272016
Molecular modeling and docking study on dopamine D2-like and serotonin 5-HT2A receptors
X Duan, M Zhang, X Zhang, F Wang, M Lei
Journal of Molecular Graphics and Modelling 57, 143-155, 2015
272015
The enantioselectivity in asymmetric ketone hydrogenation catalyzed by RuH 2 (diphosphine)(diamine) complexes: insights from a 3D-QSSR and DFT study
L Li, Y Pan, M Lei
Catalysis Science & Technology 6 (12), 4450-4457, 2016
262016
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