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Journal of the American Chemical Society|August 1, 2009
Fundamental reaction mechanism and free energy profile for (-)-cocaine hydrolysis catalyzed by cocaine esteraseJunjun Liu, Adel Hamza, Chang-Guo ZhanMolecular Biosystems|December 12, 2013
A model of glycosylated human butyrylcholinesteraseLei Fang, Fang Zheng, Chang-Guo ZhanOrganic & Biomolecular Chemistry|March 6, 2014
Reaction pathways and free energy profiles for cholinesterase-catalyzed hydrolysis of 6-monoacetylmorphineYan Qiao, Keli Han, Chang-Guo ZhanThe Journal of Physical Chemistry. B|September 10, 2011
Human butyrylcholinesterase-cocaine binding pathway and free energy profiles by molecular dynamics and potential of mean force simulationsXiaoqin Huang, Fang Zheng, Chang-Guo ZhanOrganic & Biomolecular Chemistry|May 29, 2015
Fundamental reaction pathway and free energy profile of proteasome inhibition by syringolin A (SylA)Donghui Wei, Mingsheng Tang, Chang-Guo ZhanScientific Reports|February 12, 2021
Clinical data mining reveals analgesic effects of lapatinib in cancer patientsShuo Zhou, Fang Zheng, Chang-Guo ZhanOrganic Letters|May 18, 2013
Biomimetic asymmetric 1,3-dioplar cycloaddition: amino acid precursors in biosynthesis serve as latent azomethine ylidesChang Guo, Jin Song, Liu-Zhu GongThe AAPS Journal|March 23, 2018
Improved Prediction of Blood-Brain Barrier Permeability Through Machine Learning with Combined Use of Molecular Property-Based Descriptors and FingerprintsYaxia Yuan, Fang Zheng, Chang-Guo ZhanChemical Physics Letters|March 31, 2015
Reaction Pathway and Free Energy Barrier for Urea Elimination in Aqueous SolutionMin Yao, Xi Chen, Chang-Guo ZhanThe Journal of Physical Chemistry. B|August 19, 2007
First-principles calculation of pKa for cocaine, nicotine, neurotransmitters, and anilines in aqueous solutionHaiting Lu, Xi Chen, Chang-Guo ZhanPageof 76