朱維良，研究員 1998年4月畢業於中國科學院上海藥物研究所，獲博士學位。
基本介紹
- 中文名：朱維良
- 國籍：中國
- 民族：漢
- 畢業院校：中國科學院上海藥物研究所
- 主要成就：博士生導師
- 學歷：博士
- 性別：男
- 職稱：上海藥物研究所研究員
概述,研究方向,專家類別,職務,承擔科研項目情況,代表論著,
概述
現任中國科學院上海藥物研究所研究員、博士生導師、課題組長。2004年3月獲得“引進國外傑出人才”入選資格，2005年8月獲得中國科學院“百人計畫 ”擇優資助，2006年8月獲上海市“浦江人才”稱號。曾任揚州大學農學院助教、講師，新加坡理工學院（ Singapore Polytechnic ）生命科學系及生命科學技術中心講座講師（ Visiting Lecturer ）及講師（ Lecturer )。
研究方向
專家類別
研究員；百人計畫
職務
中科院上海藥物所研究員、博士生導師、研究組長、藥物發現與設計中心主任
承擔科研項目情況
主持了“ 863 ”項目、國家科技攻關項目、國家自然科學基金、 中國科學院“百人計畫”課題、 上海市科委基礎重大基金等科研項目，研究工作涉及計算生物物理化學、藥物設計學和計算化學等領域。
代表論著
課題組成立以來共發表SCI研究論文100餘篇，遞交專利申請34件，應邀在國內外學術大會上做報告30餘次，參加編寫及翻譯專著5部。近5年發表的部分論文如下：
Jing Deng, Ning Li, Hongchuan Liu, Zhili Zuo, Oi Wah Liew, Weijun Xu, Gang Chen, Xiankun Tong, Wei Tang*, Jin Zhu, Jianping Zuo, Hualiang Jiang, Cai-Guang Yang*, Jian Li*, Weiliang Zhu*, Discovery of Novel Small Molecule Inhibitors of Dengue Viral NS2BNS3 Protease Using Virtual Screening and Scaffold Hopping, J. Med. Chem
Yunxiang Lu, Yingtao Liu, Haiying Li, Xiang Zhu, Honglai Liu, and Weiliang Zhu, Energetic Effects between Halogen Bonds and Anion-π or Lone Pair-π Interactions: A Theoretical Study, The Journal of Physical Chemistry A
Jinwei Wu, Peng Sun, Xiaodong Zhang, Hong Liu, Hualiang Jiang, Weiliang Zhu, Heyao Wang*. Inhibition of GPR40 protects MIN6 β-cells from palmitate-induced ER stress and apoptosis. Journal of Cellular Biochemistry
Di Wang, Fei Wang, Yexiong Tan, Liwei Dong, Lei Chen, Weiliang Zhu*, Hongyang Wang*, Discovery of potent small molecule inhibitors of DYRK1A by structure-based virtual screening and bioassay, Bioorganic & Medicinal Chemistry Letters
Yunxiang Lu*, Haiying Li, Xiang Zhu, Honglai Liu, Weiliang Zhu, Effects of solvent on weak halogen bonds: Density functional theory calculations, International Journal of Quantum Chemistry
Xue-lian Zhu, Hai-yan Cai, Zhi-jian Xu, Yong Wang, He-yao Wang, Ao Zhang and Wei-liang Zhu*. Classification of 5-HT(1A) receptor agonists and antagonists using GA-SVM method. Acta Pharmacol Sin.
Lu Junming, Lu Yunxiang, Yang Subin, Zhu Weiliang*, Theoretical and crystallographic data investigations of noncovalent S···O interactions, Structural Chemistry
Lu Y*, Li H, Zhu X, Zhu W, Liu H. How does halogen bonding behave in solution? A theoretical study using implicit solvation model. J. Phys Chem A.
Zhijian Xu1, Zheng Liu1, Tong Chen1, Tiantian Chen, Zhen Wang, Guanghui Tian, Jing Shi, Xuelan Wang, Yunxiang Lu, Xiuhua Yan, Guan Wang, Hualiang Jiang, Kaixian Chen, Shudong Wang, Yechun Xu*, Jingshan Shen*, Weilang Zhu*, Utilization of Halogen Bond in Lead Optimization: a Case Study of Rational Design of Potent Phosphodiesterase Type 5 (PDE5) Inhibitors, J. Med. Chem
Junming Lu, Bo Zhang, Qingming Deng, Jinan Wang, Yunxiang Lu*, Weiliang Zhu*, The Nature and Magnitude of Specific Halogen Bonds between Iodo-perfluorobenzene and Heterocyclic Systems, International Journal of Quantum Chemistry
Jinan Wang, Huaiyu Yang, Zhili Zuo, Xiuhua Yan, Yong Wang, Xiaomin Luo, Hualiang Jiang, Kaixian Chen, Weiliang Zhu*, Molecular Dynamics Simulations on the Mechanism of Transporting Methylamine and Ammonia by Ammonium Transporter AmtB, J. Phys. Chem. B
Weijun Xun; Gang Chen; Weiliang Zhu*, Zhili Zuo*, Molecular docking and Structure-Activity Relationship Studies on Benzothiazole based non-peptidic BACE-1 inhibitors, Bioorganic & Medicinal Chemistry Letters
Xiaodong Zhang, Guirui Yan, Yiming Li, Weiliang Zhu* and Heyao Wang*, DC260126, a small-molecular antagonist of GPR40, improves insulin tolerance but not glucose tolerance in obese Zucker rats, Biomedicine & Pharmacotherapy
Weijun Xu, Gang Chen, Hualiang Jiang, Weiliang Zhu*, Zhili Zuo*, Identification of a sub-micromolar Nonpeptide Inhibitor of β-secretase with low neural cytotoxicity through In-silico Screening, Bioorganic & Medicinal Chemistry Letters
Haiyan Cai, Guirui Yan, Xiaodong Zhang, Olena Gorbenko, Heyao Wang*, Weiliang Zhu*, Discovery of highly selective inhibitors of human fatty acid binding protein 4 (FABP4) by virtual screening, Bioorganic & Medicinal Chemistry Letters
Junming Lu, Yunxiang Lu*, Weiliang Zhu, Novel halogen bonding interactions between MH2 (M = Mg, Be) and HX (X = Cl, Br, I) molecules, Journal of Molecular Structure: THEOCHEM
Shao-Yong Lu, Yong-Jun Jiang*, Jing Lv, Tian-Xing Wu, Qing-Sen Yu, Wei-Liang Zhu,* Molecular docking and molecular dynamics simulation studies of GPR40 receptor–agonist interactions , Journal of Molecular Graphics and Modelling
Yunxiang Lu, Yong Wang and Weiliang Zhu*, Nonbonding interactions of organic halogens in biological systems: implications for drug discovery and biomolecular design, Physical Chemistry Chemical Physics
Zhi Chen, Guanghui Tian, Zhen Wang, Hualiang Jiang, Jingshan Shen*, and Weiliang Zhu*, Multiple Pharmacophore Models Combined with Molecular Docking: A Reliable Way for Efficiently Identifying Novel PDE4 Inhibitors with High Structural Diversity, J. Chem. Inf. Model.
Nan Li, Fei Wang, Siqiang Niu, Ju Cao, Kaifeng Wu, Youqiang Li, Nanlin Yin, Xuemei Zhang, Weiliang Zhu and Yibing Yin, Discovery of novel inhibitors of Streptococcus pneumoniae based on the virtual screening with the homology-modeled structure of histidine kinase (VicK), BMC Microbiology
Hui Hu, Lingyan He, Zhen Gong, Ning Li, Yina Lu Qiwei Zhai, Hong Liu, Hualiang Jiang, Weiliang Zhu,* Heyao Wang*, A novel class of antagonists for the FFAs receptor GPR40, Biochem Biophys Res Commun
Kunqian Yu, Cheng Luo, Guangrong Qin, Zhijian Xu, Ning Li, Hong Liu, Xu Shen, Jianpeng Ma, Qinghua Wang, Caiguang Yang, Weiliang Zhu*, Hualiang Jiang*, Why are oseltamivir and zanamivir effective against the newly emerged influenza A virus
Yunxiang Lu, Yong Wang, Zhijian Xu, Xiuhua Yan, Xiaoming Luo, Hualiang Jiang, and Weiliang Zhu*, C−X···H Contacts in Biomolecular Systems: How They Contribute to Protein-Ligand Binding Affinity? J. Phys. Chem
Yunxiang Lu, Ting Shi, Yong Wang, Huaiyu Yang, Xiuhua Yan, Xiaoming Luo, Hualiang Jiang, Weiliang Zhu*, Halogen Bonding — A Novel Interaction for Rational Drug Design, J. Med. Chem
Zhili Zuo, Oi Wah Liew, Gang Chen, Pek Ching Jenny Chong, Siew Hui Lee, Kaixian Chen, Hualiang Jiang, Chum Mok Puah*, Weiliang Zhu*, Mechanism of NS2B-mediated activation of NS3pro in Dengue Virus: Molecular Dynamics Simulations and Bioassay Studies, J. Virology
Weijun Xu, Gang Chen, Oi Wah Liew, Zhili Zuo*, Hualiang Jiang, Weiliang Zhu*, Novel non-peptide b-secretase inhibitors derived from structure-based virtual screening and bioassay Bioorganic & Medicinal Chemistry Letters
Mingyue Zheng, Xiaomin Luo, Qiancheng Shen,Yong Wang, Yun Du, Weiliang Zhu and Hualiang Jiang, Site of Metabolism (SOM) Prediction for Six Biotransformations Mediated by Cytochromes P450, Bioinformatics
李波，朱維良*，陳凱先*，小檗鹼及其衍生物的研究進展，藥學學報
Lingyan He, Jiagao Cheng, Tao Wang, Caimei Li, Zhen Gong, Hong Liu*, Bu-Bing Zeng*, Hualiang Jiang, Weiliang Zhu*, Cation–p complexes formed between cyclooctatetraene and alkaline earth metals: Predicted and recorded NMR features, Chemical Physics Letters
Zhi-Li ZUO, Gang CHEN, Xiao-Min LUO, Chum-Mok PUAH*, Wei-Liang ZHU*, Kai-Xian CHEN, Hua-Liang JIANG. Pharmacophore-Directed Homology Modeling and MD Simulation of G-protein-Coupled Receptor: Study of Possible Binding Modes of the 5-HT2C Receptor Agonists, Acta Biochimica et Biophysica Sinica
Wei Fu1,3, Jianhua Shen1, Xiaomin Luo1, Weiliang Zhu1*, Jiagao Cheng1, Kunqian Yu1, James M. Briggs2, Guozhang Jin1, Kaixian Chen1 and Hualiang Jiang1,4*, Dopamine D1 Receptor Agonist and D2 Receptor Antagonist Effects of the Natural Product (-)-Stepholidine (SPD): Molecular Modeling and Dynamics Simulations, Biophysics Journal
Zhili Zuo, Chen Gang, Hanjun Zou, Puah Chum Mok, Weiliang Zhu*, Kaixian Chen, Hualiang Jiang,. Why does β-secretase zymogen possess catalytic activity? Molecular modeling and molecular dynamics simulation studies, Computational Biology and Chemistry
Chunshan Gui, Weiliang Zhu*, Gang Chen, Xiaomin Luo, Oi Wah Liew, Chum Mok Puah, Kaixian Chen, and Hualiang Jiang*, Understanding the Regulation Mechanisms of PAF Receptor by Agonists and Antagonists: Molecular Modeling and Molecular Dynamics Simulation Studies, Proteins: Structure, Function, and Bioinformatics
Jiagao Cheng, Zhen Gong, Weiliang Zhu*, Yun Tang, Weihua Li, Zhong Li, Hualiang Jiang*, Cation sitting in aromatic cages: ab initio computational studies on tetramethylamonium–(benzene)n (n=3-4) complexes, JOPC
Huaiyu Yang, Yechun Xu, Weiliang Zhu*, Kaixian Chen and Hualiang Jiang*, Detailed Mechanism for AmtB Conducting NH4+/NH3: Molecular Dynamics Simulations, Biophysics Journal
