 | 姓名 | 许磊 |
| 职务/职称 | 副教授 | |
| 研究方向 | 计算机辅助药物设计、分子模拟、机器学习、先导化合物的设计与优化 |
许磊，男，1983年生，山东潍坊人，博士研究生，浙江大学博士后，副教授，硕士研究生导师。2012年至今以第一作者/并列一作、通讯作者在国内外著名期刊发表SCI论文30余篇，引用超过1000次，担任Frontiers in Molecular Biosciences专刊客座编辑及多个SCI期刊审稿人，已申请发明专利10余项，参与出版专著1部，获得市厅级科研成果奖项3项。先后主持国家自科基金青年基金1项，国家自科基金理论物理专项1项，中国博士后基金1项，江苏省重点研发社会发展项目1项，常州市应用基础研究1项，企业横向课题2项。
论文发表：
[1] Chun Zhang; Ying Zhang; Liangxu Xie; Xiaohua Lu; Rongzhi Mao; Lei Xu, Xiaojun Xu; Developing an Improved Cycle Architecture for AI-based Generation of New Structures Aimed at Drug Discovery, Molecules, 2024, 29(7): 1499 (期刊论文) (并列通讯作者)
[2] Ying Zhang; Liangxu Xie; Dawei Zhang; Xiaojun Xu; Lei Xu; Application of Machine Learning Methods to Predict the Air Half-lives of Persistent Organic Pollutants, Molecules, 2023, 28(22): 7457 (期刊论文) (并列通讯作者)
[3] Lingling Wang; Lei Xu; Zhe Wang; Tingjun Hou; Haiping Hao; Huiyong; Cooperation of Structural Motifs Controls Drug Selectivity in Cyclin-dependent Kinases: an Advanced Theoretical Analysis, Briefings in Bioinformatics, 2023, 24(1): bbac544 (期刊论文) (并列第一作者)
[4] Lei Xu; Liangxu Xie; Dawei Zhang; Xiaojun Xu; Elucidation of Binding Features and Dissociation Pathways of Inhibitors and Modulators in SARS-CoV-2 Main Protease by Multiple Molecular Dynamics Simulations, Molecules, 2022, 27(20): 6823. (期刊论文) (唯一通讯作者)
[5] Yu Zhang; Lei Xu; Jie Pan; Yao Zhang; Sheng Tian; Huanting Li; Bowen Gao; Ming Sang; Tingjun Hou; Xuechu Zhen; Longtai Zheng; Discovery of Novel MIF Inhibitors That Attenuate Microglial Inflammatory Activation by Structures-based Virtual Screening and in Vitro Bioassays, Acta Pharmacologica Sinica, 2022, 43(6): 1508-1520 (期刊论文) (并列第一作者)
[6] Lei Xu; Lilei Sun; Liangxu Xie; Shanzhi Mou; Dawei Zhang; Jingyu Zhu; Peng Xu; Advances in L-Type Calcium Channel Structures, Functions and Molecular Modeling, Current Medicinal Chemistry, 2021, 28(3): 514-524 (期刊论文) (并列通讯作者)
