Kunqian Yu

    Associate Professor





    e-mail: kqyu@mail.shcnc.ac.cn

 
 

EDUCATIONAL BACKGROUND

 
Jul. 2004-Now  Shanghai Institute of Meteria Medica, Chinese Academy of Sciences, Associate Professor
Jul. 2002-Jul. 2004  Shanghai Institute of Meteria Medica, Chinese Academy of Sciences, Postdoctor,
Sept.1999-July. 2002  Jilin University, Ph.D.
Sept.1997-July.1999  Jilin University,Master
Sept.1994-July.1997  Hunan Normal University, Bachelor
 
 

EDUCATIONAL BACKGROUND

 
Sept.1999-Sept.2000.  Teaching Assistant, Jilin University
 

RESEARCH

 
  1. Molecular modeling by molecular mechanics and molecular dynamics simulation.
  2. Biomolecular recognition and their interaction .
  3. Virtual screening and
 
 

REPRESENTATIVE PUBLICATIONS

 

 

1.Kunqian Yu, Wei Fu, Hong Liu, Xiaomin Luo, Kai Xian Chen, Jianping Ding, Jianhua Shen, and Hualiang Jiang Computational Simulations of Interactions of Scorpion Toxins with the Voltage-Gated Potassium Ion Channe. Biophys. J. 86, 3542-3555 ( 2004 )

2. Kun-qian Yu, Ze-sheng Li, Jia-zhong Sun, “Diffusion Coefficients of Oligomeric Penetrants in Rubbery Polymer Matrixes: A molecular dynamics study”, Chemical Journal of Chinese Universities,2002 Vol.23 No.7,1327

3. Kun-qian Yu, Ze-sheng Li, Jia-zhong Sun, “Molecular Dynamics Simulation of Self-assembled Layer-by-layer Structures of Chiral Molecules on Substrate”, Langmuir, 2002, 18, 1419

4 Kun-qian Yu, Ze-sheng Li, Jia-zhong Sun, “Polymer Structures and Glass Transition: A Molecular Dynamics Study”, Macromolecular Theory and Simulation, 2001, 10,

5. Xiaoqin Huang, Hong Liu, Meng Cui, Wei Fu, Kunqian Yu, Kaixian Chen, Xiaomin Luo, Jianhua Shen and Hualiang Jiang, Simulating the Interactions of Toxins with K+ Channels Current Pharmaceutical Design, 2004, 10, 1057-1067

6. FU Wei, FENG Ji-Kang，Yu Kun-Qian，REN Ai-Min，CUI Meng, LI Yao-Xian, SUN Chia-Chung， “Theoretical study on second-order nonlinear optical properties of unsymmetric bis(phenylethynyl)benzene series derivatives” Chinese Journal of Chemistry, 2000,18,No.2,

7. Su-Fan Wang, Ji-Kang Feng, Kun-Qian Yu, Meng Cui, etc, “DFT studies of structures and vibrational spectra of silicon-sulfur clusters (SiS2)+n (n=1-5), Journal of Molecular Structure (Theo Chem), 2000, 499

8. Fu Wei, JiKang Feng, KunQian Yu, AiMin Ren, ChiaChung Sun, “Theoretical studies of molecules with NLO properties on push-pull multi-cycle electro-optical polymer intermediates including thiophene ring” Chinese Journal of Chemistry, 2000,18

9. J. K. Feng, X. Y. Sun, A. M. Ren, K. Q. Yu, C. C. Sun, “Comparative study of the second-order optical properties of spiroconjugated compounds versus the corresponding polyenes and polyphonylenes” , Journal of Molecular Structure (Theo Chem), 1999, 489

10. Xiubin zhang, Ze-sheng Li, zhongyuan lu, kunqian Yu, Jia-zhong Sun,"Theoretical Simulation of the Interaction Between Cu and the Surface of Polyimides",Chemical Journal of Chinese Universities,2001,22 ,12,