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教育工作经历

2016.03 – 至今:福州大学化学学院 福建省“闽江学者”特聘教授 
  2015.09 – 2015.12:德国亚琛工业大学医学院 博士后 
  (导师及合作者:Prof. Giulia Rossetti) 
  2015.01 – 2015.09:德国于利希研究中心神经科学与医药研究所 博士后 
  (导师及合作者:Prof. Paolo Carloni) 
  2011.08 – 2015.02:德国亚琛工业大学/德国模拟科学研究院 计算生物学 博士 
  (导师:Prof. Bernhard Luescher 和 Prof. Paolo   Carloni) 
  2010.08 – 2011.07:荷兰阿姆斯特丹大学 化学 硕士 
  (导师:Prof. Francoise Delbecq 和 Prof. Paul   Fleurat-Lessard) 
  2010.08 – 2011.07:法国里昂高等师范学院 材料科学 硕士 
  (导师:Prof. Francoise Delbecq 和 Prof. Paul   Fleurat-Lessard) 
  2007.09 – 2010.07:南京工业大学 化学工程 硕士 
  (导师:朱小蕾教授) 
  2003.09 – 2007.07:南京工业大学 环境科学 学士

教学简介

普通化学

科研简介

课题组主要从事计算生物化学与医药的方法学和相关应用研究。目前,研究方向包括: 
  1) 分子模拟和计算生物化学方法学开发 
  2) 重大疾病中新颖靶标的构象和动力学性质的理论研究,及其抑制剂的计算机辅助设计与分子改造 
  3) 新型光敏剂分子设计,及其与蛋白质、细胞膜结合的多尺度研究 
  4) 生物大分子与功能材料相互作用的多尺度研究 
  5) 生物质谱环境下蛋白质结构预测方法的开发和应用

社会兼职


科研项目

现主持: 

闽江学者特聘教授科研启动项目(526258),2016.04-2019.03 

国家自然科学基金青年项目(21603033),2017.01-2019.12

固体表面物理化学国家重点实验室开放课题(201712),2018.01-2019.12

代表性论文

19. Y. Jia, J. Li*, J.   Chen, P. Hu, L. Jiang, X. Chen, M. Huang, Z. Chen*, P. Xu*. Smart   Photosensitizer: Tumor-Triggered Oncotherapy by Self-Assembly Photodynamic   Nanodots. ACS Applied Materials   & Interfaces, 2018,   doi: 10.1021/acsami.7b19058.

18. Y. Huang, Y. Liu, Y. Chen, M.   Song, M. Huang, J. Xue, L. Liu*, J. Li*.   Probing the interactions of phthalocyanine-based photosensitizers with model   phospholipid bilayer by molecular dynamics simulations. Journal of Porphyrins and Phthalocyanines, 2018, 22, 1.

17. J.   Li, P. Fleurat-Lessard, F. Zaera, F. Delbecq. Switch in   Relative Stability between cis and trans 2‑Butene on Pt(111) as a Function of   Experimental Conditions: A Density Functional Theory Study. ACS Catalysis2018, 8, 3067.

16.   J. Li, W. Lyu, G.Rossetti, A. Konijnenberg, A. Natalello, E. Ippolitti,   M. Orozco, R. Grandori, P. Carloni. Proton dynamics in protein mass   spectrometry. Journal of   Physical Chemistry Letter2017,   8, 1105. 
  15. J. Li, J. Vervoorts-Weber, P.   Carloni, G. Rossetti, B. Lüscher. Structural prediction of the interaction of   the tumor suppressor p27KIP1 with cyclin A/CDK2 identifies a novel   catalytically relevant determinant. BMC   Bioinformatics2017,   18, 15. 
  14. J. Chen, H. Ye, M. Zhang, J. Li,   J, Liu, J. Xue. Erlotinib Analogue‐substituted   Zinc(II) Phthalocyanines for Small Molecular Target‐based Photodynamic Cancer Therapy. Chinese Journal of Chemistry2016, 34, 10. 
  13. D. Fahrenkamp#, J. Li#, S.   Ernst, H. Schmitz-Van de Leur, N. Chatain, A. Kuster, S. Koschmieder, B.   Lüscher, G. Rossetti, G. Muller-Newen. Intramolecular hydrophobic   interactions are critical mediators of STAT5 dimerization. Scientific Reports2016, 6, 35454. (#contributed   equally) 
  12. J. Li, C. Santambrogio, S.   Brocca, G. Rossetti, P. Carloni, R. Grandori. Conformational effects in   protein electrospray-ionization mass spectrometry. Mass Spectrometry Reviews2016, 35, 111. 
  11. J. Li, L. Jiang, X. Zhu.   Computational studies of the binding mechanisms of fullerenes to human serum   albumin. Journal of Molecular   Modeling2015, 21,   2728. 
  10. J. Li, F. Flick, P. Carloni,   B. Lüscher, G. Rossetti. Insight into the mechanism of intramolecular   inhibition of the catalytic activity of sirtuin 2. PLoS ONE2015,   10, e0139095. 
  9. A. D’Urzo, A. Konijnenberg, G. Rossetti, J. Habchi, J. Li, P. Carloni, F. Sobott, S. Longhi, R. Grandori. Molecular   basis for structural heterogeneity of an intrinsically disordered protein   bound to a partner by combined ESI-IM-MS and modeling. Journal of the American Society for   Mass Spectrometry2015,   26, 472. 
  8. J. Li, G. Rossetti, J. Dreyer,   S. Raugei, E. Ippoliti, B. Lüscher, P. Carloni. Molecular simulation-based   structural prediction of protein complexes in mass spectrometry: The human   insulin dimer. PLoS   Computational Biology2014,   10, e1003838. 
  7. J. Li, P. Fleurat-Lessard, F.   Zaera, F. Delbecq. Mechanistic investigation of the cis/trans isomerization   of 2-butene on Pt(111): DFT study of the influence of the hydrogen   coverage. Journal of Catalysis2014, 311, 190. 
  6. R. Shi, J. Li, X. Cao, X. Zhu,   X. Lu. Exploration of the binding of proton pump inhibitors to human P450 2C9   based on docking and molecular dynamics simulation, Journal of Molecular Modeling2011, 17, 1941. 
  5. J. Li, X. Zhu, C. Yang, R. Shi.   Exploration of the binding of benzimidazole-biphenyl derivatives to   hemoglobin using docking and molecular dynamics simulation, International Journal of Biological   Macromolecules2011,   48, 20. 
  4. C. Yang, X. Zhu, J. Li, R. Shi.   Exploration of the mechanism for LPFFD inhibiting the formation of β-sheet   conformation of Aβ(1-42) in water, Journal   of Molecular Modeling2010,   16, 813. 
  3. J. Li, X. Zhu, C. Yang, R. Shi.   Characterization of the binding of angiotensin II receptor blockers to human   serum albumin using docking and molecular dynamics simulation, Journal of Molecular Modeling2010, 16, 789. 
  2. C. Yang, X. Zhu, J. Li, K.   Chen. Molecular dynamics simulation study on conformational behavior of   Aβ(1–40) and Aβ(1–42) in water and methanol, Journal of Molecular Structure: THEOCHEM2009, 907, 51. 
  1. C. Yang, J. Li, Y. Li, X. Zhu.   The effect of solvents on the conformations of Amyloid β-peptide (1–42)   studied by molecular dynamics simulation, Journal   of Molecular Structure: THEOCHEM2009, 895, 1.

会议报告

7. 邀请报告,第九届国际分子模拟与信息技术应用学术会议,太原,2018.05.

6. 口头报告,中国化学会第31届学术年会,杭州,2018.05.

5. 口头报告,第三届全国质谱分析学术报告会,厦门,2017.12.

4. 口头报告,第五届华南结构生物学会议,福州,2017.11.

3. 口头报告,第十三届全国量子化学会议,大连,2017.06.

2. 口头报告,The 4th   International Conference on Molecular Simulation,上海,2016.10.

1. 邀请报告&分会场主席,The 6th International Conference on the Development of Biomedical   Engineering,HCM City,Vietnam,2016.06.

课题组成员

博士后:柳林

博士生:宋美如(17级),刘以畅(18级)

硕士生:陈亚玉(15级,黄明东教授合作指导),谢道情(16级),董昕(17级),齐迎迎(17级),黄宇超(17级)

 

本科生:黄福成(14级),黄晓琳(15级),郑明文(16级),郭楠欣(17级)

获奖情况

2010 欧盟委员会伊拉斯莫斯奖学金

其他

课题组与德国于利希研究中心(http://www.fz-juelich.de/ias/ias-5/EN/Home/home_node.html)和德国模拟科学研究院(http://www.grs-sim.de/)长期合作,联合培养博士生,并支持优秀的硕士生、博士生和博士后赴德交流学习,欢迎有志从事计算生物医药研究的同学与我们联系。 

课题组与德国于利希研究中心/亚琛工业大学联合申请的2018年度“中德博士后交流项目”已获批准,目前正在寻找合适的博士后,项目期2待遇:中方30万+德方1500欧元/,详情请参考小木虫招聘广告信息: 

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