(1) Yanwei Li*, Yue Yue, Hongxia Zhang, Zhongyue Yang, Hui Wang, Shaixiao Tian, Jian-bo Wang*, Qingzhu Zhang*, Wenxing Wang. Harnessing fluoroacetate dehalogenase for defluorination of fluorocarboxylic acids: in silico and in vitro approach. Environment International, 2019, 131, 104999.
(2) Xiaodan Wang, Jinfeng Chen, Xiaowen Tang, Junjie Wang, Ledong Zhu, Weixin Zhang, Hui Wang, Yanwei Li*, Qingzhu Zhang. Biodegradation mechanism of polyesters by hydrolase from Rhodopseudomonas palustris: An in silico approach. Chemosphere, 2019, 221, 11-20.
(3) Lei Bao, Wen Liu, Yanwei Li*, Xueyu Wang, Fei Xu, Zhongyue Yang, Yue Yue, Chenpeng Zuo, Qingzhu Zhang* and Wenxing Wang, Carcinogenic Metabolic Activation Process of Naphthalene by the Cytochrome P450 Enzyme 1B1: A Computational Study. Chemical Research Toxicololy, 2019, 32, 603-612.
(4) Pijun Duan, Tengfei Ma, Yue Yue, Yanwei Li*, Xue Zhang, Yanan Shang, Baoyu Gao, Qingzhu Zhang, Qinyan Yue and Xing Xu*. Fe/Mn nanoparticles encapsulated in nitrogen-doped carbon nanotubes as a peroxymonosulfate activator for acetamiprid degradation. Environmental Science: Nano, 2019, 6, 1799-1811.
(5) Jianxin Guan#, Chuancheng Jia#, Yanwei Li#, Zitong Liu#, Jinying Wang, Zhongyue Yang, Chunhui Gu, Dingkai Su, Kendall N. Houk*, Deqing Zhang*, and Xuefeng Guo*, Direct single-molecule dynamic detection of chemical reactions. Science Advances, 2018, 4, eaar2177. (Highlighted by C&EN)
(6) Zhongyue Yang#, Song Yang#, Peiyuan Yu#, Yanwei Li#, Charles Doubleday, Jiyong Park, Ashay Patel, Byung-sun Jeon, William K. Russell, Hung-wen Liu, David H. Russell, and Kendall N. Houk*, Influence of water and enzyme SpnF on the dynamics and energetics of the ambimodal [6+4]/[4+2] cycloaddition, Proceedings of the National Academy of Sciences of the United States of America, 2018, 115, E848-E855.
(7) Yanwei Li, Xiaodan Wang, Ruiming Zhang, Junjie Wang, Zhongyue Yang, Likai Du*, Xiaowen Tang, Qingzhu Zhang*, Wenxing Wang, Computational Evidence for the Enzymatic Transformation of 2-hydroxypropylphosphonate to Methylphosphonate, ACS Earth and Space Chemistry, 2018, 2, 888−894.
(8) Yanwei Li, Ruiming Zhang, Likai Du, Qingzhu Zhang*, Wenxing Wang, Catalytic mechanism of C-F bond cleavage: insights from QM/MM analysis of fluoroacetate dehalogenase, Catalysis Science & Technology, 2016, 6(1): 73-80. (Outside Front Cover)
(9) Yanwei Li, Ruiming Zhang, Likai Du, Qingzhu Zhang*, Wenxing Wang, How Many Conformations of Enzymes Should Be Sampled for DFT/MM Calculations? A Case Study of Fluoroacetate Dehalogenase, International Journal of Molecular Sciences, 2016, 17(8), 1372.
(10) Yanwei Li, Xiangli Shi , Qingzhu Zhang*, Jingtian Hu, Jianmin Chen, and Wenxing Wang, Computational Evidence for the Detoxifying Mechanism of Epsilon Class Glutathione Transferase Toward the Insecticide DDT, Environmental Science & Technology, 2014, 48 (9): 5008-5016.