李卫华 收藏
( 任职于 药学院)
1999年毕业于安徽师范大学化学系，获得学士学位；2002年毕业于华南师范大学化学系，获得硕士学位；2005年毕业于中科院上海药物研究所，获得博士学位。2005年9月至2007年6月在华东理工大学药学院从事博士后研究；2007年7月至2009年6月获得日本学术振兴会（JSPS）奖学金，在日本千叶大学药学部从事博士后研究。2009年9月到华东理工大学药学院工作，任副研究员；2018年9月晋升教授。 近年来一直从事生物大分子特别是蛋白质的计算模拟和计算机辅助药物设计工作。运用分子模拟和药物设计技术，围绕药物代谢酶P450的催化代谢机制、化合物ADMET性质预测... 详细>>
被引量：9,719H指数：44SCI-EXPANDED： 212 EI： 78 北大核心： 9 CSCD： 7 SSCI： 1
- admetSAR: A Comprehensive Source and Free Tool for Assessment of Chemical ADMET Properties被引量：1485收藏
- 作者：Cheng, Feixiong Li, Weihua Zhou, Yadi Shen, Jie Wu, Zengrui Liu, Guixia Lee, Philip W. Tang, Yun
- 机构：E China Univ Sci & Technol
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2012
- 关键词：Industrial chemicals - Classification (of information) - Regression analysis - Consumer products - Indicators (chemical) - Additives - Chemical contamination - Database systems
- 质疑
- admetSAR 2.0: web-service for prediction and optimization of chemical ADMET properties被引量：915收藏
- 作者：Yang, Hongbin Lou, Chaofeng Sun, Lixia Li, Jie Cai, Yingchun Wang, Zhuang Li, Weihua Liu, Guixia Tang, Yun
- 机构：East China Univ Sci & Technol
- 来源：BIOINFORMATICS 2019
- 质疑
- Prediction of Drug-Target Interactions and Drug Repositioning via Network-Based Inference被引量：626收藏
- 作者：Cheng, Feixiong Liu, Chuang Jiang, Jing Lu, Weiqiang Li, Weihua Liu, Guixia Zhou, Weixing Huang, Jin Tang, Yun
- 机构：E China Univ Sci & Technol;E China Univ Sci & Technol
- 来源：PLOS COMPUTATIONAL BIOLOGY 2012
- 关键词：Cell culture - Complex networks - Computation theory - Drug interactions - Tensors
- 质疑
- ADMET-score - a comprehensive scoring function for evaluation of chemical drug-likeness被引量：436收藏
- 作者：Guan, Longfei Yang, Hongbin Cai, Yingchun Sun, Lixia Di, Peiwen Li, Weihua Liu, Guixia Tang, Yun
- 机构：East China Univ Sci & Technol
- 来源：MEDCHEMCOMM 2019
- 质疑
- Estimation of ADME Properties with Substructure Pattern Recognition被引量：269收藏
- 作者：Shen, Jie Cheng, Feixiong Xu, You Li, Weihua Tang, Yun
- 机构：E China Univ Sci & Technol
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2010
- 关键词：Support vector machines - Chemical analysis
- 质疑
- In Silico ADMET Prediction : Recent Advances, Current Challenges and Future Trends被引量：201收藏
- 作者：Cheng, Feixiong Li, Weihua Liu, Guixia Tang, Yun
- 机构：E China Univ Sci & Technol
- 来源：CURRENT TOPICS IN MEDICINAL CHEMISTRY 2013
- 关键词：ADMET drug discovery hazard risk assessment systems toxicology QSAR data-integration combined classifier substructure pattern recognition
- 质疑
- In Silico Prediction of Chemical Toxicity for Drug Design Using Machine Learning Methods and Structural Alerts被引量：168收藏
- 作者：Yang, Hongbin Sun, Lixia Li, Weihua Liu, Guixia Tang, Yun
- 机构：East China Univ Sci & Technol
- 来源：FRONTIERS IN CHEMISTRY 2018
- 关键词：drug safety chemical toxicity drug design machine learning structural alerts
- 质疑
- In silico Prediction of Chemical Ames Mutagenicity被引量：168收藏
- 作者：Xu, Congying Cheng, Feixiong Chen, Lei Du, Zheng Li, Weihua Liu, Guixia Lee, Philip W. Tang, Yun
- 机构：E China Univ Sci & Technol;Chinese Acad Sci
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2012
- 关键词：Decision trees - Forecasting - Neural networks - Nearest neighbor search
- 质疑
- Network-Based Methods and Their Applications in Drug Discovery被引量：166收藏
- 作者：Yu, Zhuohang Wu, Zengrui Wang, Ze Wang, Yimeng Zhou, Moran Li, Weihua Liu, Guixia Tang, Yun
- 机构： Shanghai Frontiers Science Center of Optogenetic Techniques for Cell Metabolism
- 来源：Journal of Chemical Information and Modeling 2024
- 质疑
- Classification of Cytochrome P450 Inhibitors and Noninhibitors Using Combined Classifiers被引量：164收藏
- 作者：Cheng, Feixiong Yu, Yue Shen, Jie Yang, Lei Li, Weihua Liu, Guixia Lee, Philip W. Tang, Yun
- 机构：E China Univ Sci & Technol;Kyoto Univ;E China Univ Sci & Technol
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2011
- 关键词：Decision trees - Data mining - Nearest neighbor search - Classification (of information) - Drug interactions - Backpropagation - Forecasting
- 质疑
- In Silico Prediction of Chemical Acute Oral Toxicity Using MultiClassification Methods被引量：147收藏
- 作者：Li, Xiao Chen, Lei Cheng, Feixiong Wu, Zengrui Bian, Hanping Xu, Congying Li, Weihua Liu, Guixia Shen, Xu Tang, Yun
- 机构：E China Univ Sci & Technol;Chinese Acad Sci
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2014
- 关键词：Risk assessment - Binary trees - Decision trees - Nearest neighbor search - Environmental Protection Agency - Barium compounds - Support vector machines
- 质疑
- ASD: a comprehensive database of allosteric proteins and modulators被引量：145收藏
- 作者：Huang, Zhimin Zhu, Liang Cao, Yan Wu, Geng Liu, Xinyi Chen, Yingyi Wang, Qi Shi, Ting Zhao, Yaxue Wang, Yuefei Li, Weihua Li, Yixue Chen, Haifeng Chen, Guoqiang Zhang, Jian
- 机构：Shanghai Jiao Tong Univ;Shanghai Jiao Tong Univ;Punan Hosp;Shanghai Jiao Tong Univ;E China Univ Sci & Technol
- 来源：NUCLEIC ACIDS RESEARCH 2011
- 质疑
- In Silico Prediction of Blood-Brain Barrier Permeability of Compounds by Machine Learning and Resampling Methods被引量：136收藏
- 作者：Wang, Zhuang Yang, Hongbin Wu, Zengrui Wang, Tianduanyi Li, Weihua Tang, Yun Liu, Guixia
- 机构：East China Univ Sci & Technol
- 来源：CHEMMEDCHEM 2018
- 关键词：blood-brain barrier imbalanced data machine learning QSAR models resampling methods
- 质疑
- Association between cigarette smoking and Parkinson's disease: A meta-analysis被引量：134收藏
- 作者：Li, Xiao Li, Weihua Liu, Guixia Shen, Xu Tang, Yun
- 机构：E China Univ Sci & Technol;Chinese Acad Sci
- 来源：ARCHIVES OF GERONTOLOGY AND GERIATRICS 2015
- 关键词：Cigarette smoking Parkinson's disease Meta-analysis Pack-year
- 质疑
- Network-Based Methods for Prediction of Drug-Target Interactions被引量：127收藏
- 作者：Wu, Zengrui Li, Weihua Liu, Guixia Tang, Yun
- 机构：East China Univ Sci & Technol
- 来源：FRONTIERS IN PHARMACOLOGY 2018
- 关键词：drug-target interaction network-based method target prediction systems pharmacology systems toxicology drug repurposing
- 质疑
- admetSAR3.0: a comprehensive platform for exploration, prediction and optimization of chemical ADMET properties被引量：122收藏
- 作者：Gu, Yaxin Yu, Zhuohang Wang, Yimeng Chen, Long Lou, Chaofeng Yang, Chen Li, Weihua Liu, Guixia Tang, Yun
- 机构：East China Univ Sci & Technol
- 来源：NUCLEIC ACIDS RESEARCH 2024
- 质疑
- Adverse Drug Events: Database Construction and in Silico Prediction被引量：105收藏
- 作者：Cheng, Feixiong Li, Weihua Wang, Xichuan Zhou, Yadi Wu, Zengrui Shen, Jie Tang, Yun
- 机构：E China Univ Sci & Technol;Shanghai MCC Hosp
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2013
- 关键词：Data mining - Drug dosage - Data integration - Drug interactions - Forecasting
- 质疑
- Performance Evaluation of 2D Fingerprint and 3D Shape Similarity Methods in Virtual Screening被引量：96收藏
- 作者：Hu, Guoping Kuang, Guanglin Xiao, Wen Li, Weihua Liu, Guixia Tang, Yun
- 机构：E China Univ Sci & Technol
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2012
- 质疑
- Prediction of chemical-protein interactions: multitarget-QSAR versus computational chemogenomic methods被引量：94收藏
- 作者：Cheng, Feixiong Zhou, Yadi Li, Jie Li, Weihua Liu, Guixia Tang, Yun
- 机构：E China Univ Sci & Technol
- 来源：MOLECULAR BIOSYSTEMS 2012
- 质疑
- In Silico Assessment of Chemical Biodegradability被引量：87收藏
- 作者：Cheng, Feixiong Ikenaga, Yutaka Zhou, Yadi Yu, Yue Li, Weihua Shen, Jie Du, Zheng Chen, Lei Xu, Congying Liu, Guixia Lee, Philip W. Tang, Yun
- 机构：E China Univ Sci & Technol;Kyoto Univ;Natl Inst Technol & Evaluat NITE
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2012
- 关键词：Biodegradation - Nearest neighbor search - Organic chemicals - Decision trees - Indicators (chemical) - International trade
- 质疑
- Prediction of Polypharmacological Profiles of Drugs by the Integration of Chemical, Side Effect, and Therapeutic Space被引量：83收藏
- 作者：Cheng, Feixiong Li, Weihua Wu, Zengrui Wang, Xichuan Zhang, Chen Li, Jie Liu, Guixia Tang, Yun
- 机构：E China Univ Sci & Technol;Shanghai MCC Hosp
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2013
- 关键词：Proteins - Tensors - Association reactions - Drug interactions
- 质疑
- Prediction of Chemical-Protein Interactions Network with Weighted Network-Based Inference Method被引量：83收藏
- 作者：Cheng, Feixiong Zhou, Yadi Li, Weihua Liu, Guixia Tang, Yun
- 机构：E China Univ Sci & Technol
- 来源：PLOS ONE 2012
- 质疑
- In silico Prediction of Drug Induced Liver Toxicity Using Substructure Pattern Recognition Method被引量：79收藏
- 作者：Zhang, Chen Cheng, Feixiong Li, Weihua Liu, Guixia Lee, Philip W. Tang, Yun
- 机构：E China Univ Sci & Technol;Vanderbilt Univ
- 来源：MOLECULAR INFORMATICS 2016
- 关键词：Drug-induced liver injury machine learning substructure pattern recognition structural alerts
- 质疑
- Exploring coumarin egress channels in human cytochrome P450 2A6 by random acceleration and steered molecular dynamics simulations被引量：79收藏
- 作者：Li, Weihua Shen, Jie Liu, Guixia Tang, Yun Hoshino, Tyuji
- 机构：E China Univ Sci & Technol;Chiba Univ
- 来源：PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS 2011
- 关键词：P450 2A6 coumarin egress channel molecular dynamics channel selectivity
- 质疑
- In silico prediction of Tetrahymena pyriformis toxicity for diverse industrial chemicals with substructure pattern recognition and machine learning methods被引量：77收藏
- 作者：Cheng, Feixiong Shen, Jie Yu, Yue Li, Weihua Liu, Guixia Lee, Philip W. Tang, Yun
- 机构：E China Univ Sci & Technol;Kyoto Univ
- 来源：CHEMOSPHERE 2011
- 关键词：Tetrahymena pyriformis toxicity Quantitative structure-toxicity relationship Substructure pattern recognition Support vector machine Machine learning Information gain
- 质疑
- Network-based identification of microRNAs as potential pharmacogenomic biomarkers for anticancer drugs被引量：74收藏
- 作者：Li, Jie Lei, Kecheng Wu, Zengrui Li, Weihua Liu, Guixia Liu, Jianwen Cheng, Feixiong Tang, Yun
- 机构：East China Univ Sci & Technol;Sichuan Univ;Harvard Med Sch;Northeastern Univ
- 来源：ONCOTARGET 2016
- 关键词：pharmacogenomics miRNA network-based inference metformin breast cancer
- 质疑
- ADMETopt: A Web Server for ADMET Optimization in Drug Design via Scaffold Hopping被引量：72收藏
- 作者：Yang, Hongbin Sun, Lixia Wang, Zhuang Li, Weihua Liu, Guixia Tang, Yun
- 机构：East China Univ Sci & Technol
- 来源：JOURNAL OF CHEMICAL INFORMATION AND MODELING 2018
- 关键词：Physicochemical properties - Scaffolds - Web services
- 质疑
- In Silico Prediction of Compounds Binding to Human Plasma Proteins by QSAR Models被引量：72收藏
- 作者：Sun, Lixia Yang, Hongbin Li, Jie Wang, Tianduanyi Li, Weihua Liu, Guixia Tang, Yun
- 机构：East China Univ Sci & Technol
- 来源：CHEMMEDCHEM 2018
- 关键词：machine learning plasma protein binding QSAR pharmacokinetics consensus modeling
- 质疑
- Computational Approaches to Identify Structural Alerts and Their Applications in Environmental Toxicology and Drug Discovery被引量：71收藏
- 作者：Yang, Hongbin Lou, Chaofeng Li, Weihua Liu, Guixia Tang, Yun
- 机构：East China Univ Sci & Technol
- 来源：CHEMICAL RESEARCH IN TOXICOLOGY 2020
- 质疑
- In silico prediction of chemical mechanism of action via an improved network-based inference method被引量：68收藏
- 作者：Wu, Zengrui Lu, Weiqiang Wu, Dang Luo, Anqi Bian, Hanping Li, Jie Li, Weihua Liu, Guixia Huang, Jin Cheng, Feixiong Tang, Yun
- 机构：East China Univ Sci & Technol;East China Normal Univ;East China Normal Univ;Sichuan Univ;Harvard Med Sch
- 来源：BRITISH JOURNAL OF PHARMACOLOGY 2016
- 质疑
