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研究领域

从物质的结构性能出发,综合运用多种理论计算方法和现代化学实验手段,着重研究蛋白质、DNA等一些重要生物分子和靶标与小分子及材料表面的作用机制和识别模式。形成了食品安全检测与预警;药物设计与合成;生物医用功能材料的分子模拟与设计等研究方向。主持、参与并完成了多项国家和省级项目,在国内外学术期刊上共发表论文90余篇,申请专利8项,主要承担和参与行业及国家标准4项,应邀学术会议报告多次,其中有的文章曾成为2000年4月英国皇家化学会的“top ten paper”之一;《瘦肉精的质子化结构和电子光谱的量子化学研究》一文获得2007年中国食品科学技术学会科技创新奖优秀论文奖一等奖。

近期论文

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Qian Wang, Wang Xu, Ping Wu, Hui Zhang, Chenxin Cai,* and Bo Zhao*, New Insights into the Effects of Thermal Treatment on the Catalytic Activity and Conformational Structure of Glucose Oxidase Studied by Electrochemistry, IRSpectroscopy, and Theoretical Calculation, J. Phys. Chem. B,2010, 114:12754–12764 Changyun Chen, Bo Zhao*, Zhengwu Wang, Interaction of thiacloprid with bovine hemoglobin using spectroscopic and molecular modeling methods, Spectroscopy, 2010, 24: 559–566 Yun Wu, HuiMao, Bo Zhao,∗ Jian Shen, The interaction of clenbuterol hydrochloride with bovine hemoglobin using spectroscopic techniques and molecular modeling methods, Spectroscopy, 2009, 23: 271 Bo Zhao*, Yuzhi Rong, Xiaohua Huang, Jingshan Shen, Experimental and theoretical study on the structure and electronic spectra of imiquimod and its synthetic intermediates, Bioorganic & Medicinal Chemistry Letters, 2007, 17: 4942–4946 Xiuming Wu, Bo Zhao, Ping Wu, Hui Zhang,* and Chenxin Cai*, Effects of Ionic Liquids on Enzymatic Catalysis of the Glucose Oxidase toward the Oxidation of Glucose J. Phys. Chem. B 2009, 113, 13365–13373

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