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  Dr. KEXIAN CHEN  
 
Address 1 :
Address 2 :
Title : Dr.
First Name : KEXIAN
Last Name : CHEN
University/Institution : Zhejiang University
Email ID : ckx_chem@zju.edu.cn
City : Hangzhou
Country : China
State : Zhejiang
Zipcode : 310027
Department : Department of Chemistry, Department of Chemical and Biological Engineering,
Company Name :
Area of Research
Physical Chemistry
Area of Expertise
Computational and Catalytic Chemistry, Drug Design and Discovery
Brief Description of Research Interest :

Physical Chemistry (Computational and Catalytic Chemistry), Drug Design and Discovery
Representative Publications :

1.    Chen K. X., et al. Quantitative structure-activity relationship studies on 1-aryl-tetrahydroisoquinoline analogs as active anti-HIV agents. Bioorg. Med. Chem. Lett. 2008, 18(20): 5381-5386.

2.   Li Z. G.*, Chen K. X., et al. Quantitative structure-activity relationship analysis of some thiourea derivatives with activities against HIV-1 (IIIB) . QSAR & Comb. Sci. 2009, 28(1): 89-97. Most accessed articles

3.   Chen K. X., et al. Quantitative structure-activity relationship studies on some novel anti-HIV thiourea derivatives with cytotoxicity data (CC50) in MT-4 cells. Lett. Drug Des. Discov. 2009, 6(3): 193-200.   

4.   Chen K. X. , et al. Quantitative structure-activity relationship analysis of aryl alkanol piperazine derivatives with antidepressant activities. Eur. J. Med. Chem. 2009, 44(11): 4367-4375.

5.   Chen K. X., et al. Quantitative structure-activity relationship of hepatitis C virus NS5B polymerase inhibitors using GFA and MFA techniques. Acta Chim. Slov. 2009, 56: 684-693.

6.   Chen K. X., et al. 2D-QSAR studies on anthranilic acid derivatives: a novel class of allosteric inhibitors of hepatitis C NS5B polymerase. Chin. J. Struct. Chem. 2009, 28(10): 1217-1225.

7.   Li Z. G.*, Chen K. X., et al. Cluster analysis and QSAR studies of some anti-hepatitis B virus agents comprising 4-aryl-6-chloro-quinolin-2-ones and 5-aryl-7-chloro-1,4-benzodiazepines. Chin. J. Chem. 2009, 27(12): 2352-2358.

8.   Li Z. G.*, Chen K. X., et al. Quantitative structure-property relationship studies on amino acid conjugates of jasmonic acid as defense signaling molecules. J. Integr. Plant Biol. 2009, 51(6): 581-592. Featured Cover Article

9.  Li Z. G.*, Chen K. X., et al. QSAR analysis of jasmonates as novel plant growth regulators. Chin. J. Pestic. Sci. 2009, 11(2): 166-175.

10. Chen K. X., et al. Exploring the structural requirements for jasmonates and related compounds as novel plant growth regulators: A current computational perspective. Plant Signal Behav. 2009, 4(11): 1007-1009. Invited Review

11.  Sun Y., Chen K. X., et al. Toward understanding macrocycle specificity of iron on the dioxygen-binding ability: A theoretical study. Phys. Chem. Chem. Phys. 2011, 13(30): 13800-13808.

12. Chen K. X., et al. Aerobic oxidation of β-isophorone catalyzed by N-hydroxyphthalimide: The key features and mechanism elucidated. Phys. Chem. Chem. Phys. 2012, 14(35): 12141-12146.

13. Chen K. X., et al. Theoretical studies on muti-hydroxyimides as highly efficient catalysts for aerobic oxidation. ChemPhysChem 2013, 14(1): 179-184.

14.  Chen K. X., et al. Highlight on direct amination of unreactive C−H bonds catalyzed by N-hydroxyphthalimide. J. Postdoc. Res. 2013, 1(8): 19-20.

15. Chen K. X., et al. Submitted

16. Chen K. X., et al.  Submitted

17. Chen K. X., et al.  Submitted

18. Chen K. X., et al.  Submitted

19. Chen K. X., et al.  Submitted

20. Chen K. X., et al.  Submitted

Conferences

1.  Chen K. X., et al. Autoxidation mechanism of β-isophorone to keto-isophorone in the environment. The 15th National Symposium on Chemical Thermodynamics and Thermal Analysis of Chinese Chemical Society. Aug. 21-25, 2010: P182-P183. Xi′an • China • Poster Presentation.

2.  Chen K. X., et al. Reorganization energies of some short-lived N-oxyl radicals. The 16th National Symposium on Chemical Thermodynamics and Thermal Analysis of Chinese Chemical Society. Oct. 19-21, 2012: P60. Wuhan • China.

3.  Chen K. X., et al. Substituent effects on the recognition of inorganic ions by selenacalix[3]triazines. World Resources Forum 2012. Oct. 14-17, 2012: P190. Beijing • China • Poster Presentation.

4. Chen K. X., et al. Electronic aspects of α/β-isophorones on their distributions of oxygenated products and photochemical applications. The 12th National Symposium of Computational Chemistry. Oct. 21-24, 2013: P . Suzhou• China.

5. Chen K. X., et al. Theoretical perspectives on the catalytic behaviors of muti-hydroxyimides towards aerobic oxidation. The 12th National Symposium of Computational Chemistry. Oct. 21-24, 2013: P . Suzhou• China.

6. Chen K. X., et al. Conformational properties and QSAR studies on jasmonates as novel ecological pesticides. The 12th National Symposium of Computational Chemistry. Oct. 21-24, 2013: P . Suzhou• China.
 
     
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