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Nanotechnology|November 20, 2009
A theoretical study of silicon-doped boron nitride nanotubes serving as a potential chemical sensor for hydrogen cyanideRuoxi Wang, Dongju Zhang, Yongjun Liu, et al.Chirality|August 31, 2010
Theoretical study on the asymmetric Michael addition of cyclohexanone with trans-beta-nitrostyrene catalyzed by a pyrrolidine-type chiral ionic liquidHui Sun, Dongju Zhang, Changqiao Zhang, et al.Journal of Inorganic Biochemistry|February 19, 2013
Metal vs. chalcogen competition in the catalytic mechanism of cysteine dioxygenaseXin Che, Jun Gao, Yongjun Liu, et al.Journal of Molecular Graphics & Modelling|June 5, 2013
Theoretical study on the proton shuttle mechanism of saccharopine dehydrogenaseXiang Sheng, Jun Gao, Yongjun Liu, et al.Biopolymers|April 20, 2017
Modeling interactions between a β-O-4 type lignin model compound and 1-allyl-3-methylimidazolium chloride ionic liquidYoutao Zhu, Jing Yan, Chengbu Liu, et al.The Journal of Organic Chemistry|September 7, 2024
Mechanistic Insights from Density Functional Theory into Rh/Acid-Catalyzed Synthesis of 1,2-Dihydroquinolines via Skeleton-Reorganizing Coupling of Cycloheptatriene and AminesJinzhao Wang, Aili Feng, Chengbu Liu, et al.Journal of Molecular Modeling|December 4, 2010
Theoretical study on the interactions between methanol and imidazolium-based ionic liquidsXueying Zhu, Hui Sun, Dongju Zhang, et al.The Journal of Physical Chemistry. A|May 4, 2010
Theoretical elucidation of Au(I)-catalyzed cycloisomerizations of cycloalkyl-substituted 1,5-enynes: 1,2-alkyl shift versus C-H bond insertion productsYuxia Liu, Dongju Zhang, Jianhua Zhou, et al.The Journal of Physical Chemistry. B|February 15, 2017
Theoretical Insight into the Conversion Mechanism of Glucose to Fructose Catalyzed by CrCl<sub>2</sub> in Imidazolium Chlorine Ionic LiquidsYaru Jing, Jun Gao, Chengbu Liu, et al.The Journal of Chemical Physics|October 12, 2004
Time-dependent four-component relativistic density functional theory for excitation energiesJun Gao, Wenjian Liu, Bo Song, et al.Pageof 10