王文亮 - 陕西师范大学 - 化学化工学院

研究领域

理论与计算化学；结构化学 (1) 有机含硫小分子大气化学反应微观动力学机理；(2) 生物分子与小分子相互作用本质与机理；(3) 有机电致发光材料的结构优化与理论设计。

近期论文

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Lingxia Jin, Wenliang Wang*, Daodao Hu, et al., A New Insight on the 5-Carboxycytosine and 5-Formylcytosine under Typical Bisulfite Conditions: A Deamination Mechanism Studies, Phys.Chem.Chem.Phys., 2014, 16 (8), 3573 – 3585. Lingxia Jin, Wenliang Wang*, Daodao Hu, et al., The Effects of Protonation and C5-methylation on the Electrophilic Addition Reaction of Cytosine: A Computational Study, J. Phys. Chem. B, 2013, 117: 3−12. Lingxia Jin, Wenliang Wang *, Daodao Hu, et al., The Conversion of Protonated [Cytosine-SO3－] to [Uracil-SO3－]: Insights into the Induced Hydrolytic Deamination through Bisulﬁte Catalysis, Phys.Chem.Chem.Phys., 2013, 15 (23): 9034 – 9042. Zhang Pei, Wang Wenliang*, Zhang Tianlei, et al., Yongmei Du, Chunying Li, Jian Lü, Theoretical Study on the Mechanism and Kinetics for the Self-reaction of C2H5O2 Radicals, J.Phys. Chem. A, 2012, 116: 4610−4620. Zhang Tianlei, Wang Wenliang*, Lü Jian, et al.,Water-catalyzed gas-phase hydrogen abstraction reactions of CH3O2 and HO2 with HO2: A computational investigation, Phys.Chem.Chem.Phys., 2011, 13: 20794-20805. Cao Jia, Wang Wenliang*, Zhang Yue ,et al., Computational study on the reaction of CH3SCH2CH3 with OH radical: mechanism and enthalpy of formation, Theor. Chem.Acc., 2011, 129: 771-780. Caibin Zhao ,Shiwei Yin, Wenliang Wang*, Theoretical investigation on charge transport parameters of two novel dicyanovinyl heterotetracenes, Synthetic Metals, 2014, 188, 146–155. Zhang Tianlei, Wang Wenliang*, Lü Jian, et al.,Water-catalyzed gas-phase hydrogen abstraction reactions of CH3O2 and HO2 with HO2: A computational investigation, RSC Advances, 2013, 3: 7381–73917. Dong Shihong, Wang Wenliang*, Yin Shiwei, et al. Theoretical studies on electronic structures and optical properties of Alq3 and its difluorinated derivatives, Synthetic Metals, 2009, 159: 385-390. Wang Wenliang*, Jin Lingxia, Wang Weina, et al., Theoretical Studies on Reaction of the Addition and Hydrogen Abstraction of OH Radical with 5-Methylcytosine, Chem. Phys. Lett., 2007, 444: 359-365.