Guixia Liu


Postdoctoral fellow

Born: January 1974, Fushun City, P. R. China

Email:gxliu@mail.shcnc.ac.cn
           gxliu121@hotmail.com

See My Profile in Chinese
 

EDUCATIONAL BACKGROUND
1999.9-2002.6 Ph.D. Physical Chemistry Ph.D. in Institute of Theoretical Chemistry, Jilin University
1997.9£­1999.7 M.Sc. Physical Chemistry Institute of Theoretical Chemistry, Jilin University
1993.9£­1997.7 B.Sc. Chemistry Liaoning Normal University
 

WORK EXPERIENCE
2002.7-Now Postdoctoral fellow Pharmaceutical Chemistry Drug Discovery and Design Center, SIMM, CAS
Sept.1999-Sept.2000 Teaching Assistant Physical Chemistry Jilin University
 

RESEARCH INTERESTS

  • Molecular modeling and computer-aided drug design
  • Molecular dynamics simulation
  • Quantum chemical studies on gas-phase reaction dynamics and fullerene derivatives
 

RECENT PUBLICATIONS

 

  1. Gui-Xia Liu, Yi-Hong Ding, Ze-Sheng Li, Xu-Ri Huang, Chia-Chung Sun, "Theoretical revisit on potential energy surface of [C3H6N]+", J. Mol. Struct. (Theochem), 2001, 548, 191-218
  2. Gui-Xia Liu, Ze-Sheng Li, Yi-Hong Ding, Qiang Fu, Xu-Ri Huang Chia-Chung Sun, Au-Chin Tang, "Water-assisted isomerization from linear propargylium (H2CCCH+) to cyclopropenylium (c-C3H3+)", J. Phys. Chem. A, 2002, 106, 10415-10422
  3. Gui-Xia Liu, Yi-Hong Ding, Ze-Sheng Li, Qiang Fu, Xu-Ri Huang, Chia-Chung Sun, Au-Chin Tang, "Theoretical study on mechanisms of the high-temperature reactions C2H3+H2O and C2H4+OH", Phys. Chem. Chem. Phys., 2002, 4, 1021-1027
  4. Gui-Xia Liu, Ze-Sheng Li, Jing-Fa Xiao, Jing-Yao Liu, Qiang Fu, Xu-Ri Huang, Chia-Chung Sun, Au-Chin Tang, "Calculations of the Rate Constants for the Hydrogen Abstraction Reactions C2H3+CH4”śC2H4+CH3 and C2H3+C2H6”śC2H4+C2H5", ChemPhysChem, 2002, No. 7, 625-629
  5. LIU Gui-Xia, DING Yi-Hong, LI Ze-Sheng, HUANG Xu-Ri, SUN Chia-Chung, "Theoretical Study on the Potential Energy Surface of the Reaction of Vinyl Radical (C2H3) with Hydroxyl Radical (OH)", Chemical Journal of Chinese Universities, 2002, 23, 1147-1150
  6. LIU Gui-Xia, ZHANG Hong-Xing, SUN Chia-Chung, TANG Ao-Qing, "A theoretical study on the structures and stability of C40 isomers", Chemical Journal of Chinese Universities, 2002, 24, 105-108