School of Chemical Science and Technology
Add:No.2 North Cuihu Road, Kunming, P. R. China
XIE Xiao-Guang
Ph.D.
Professor of Physical Chemistry
Doctor Advisor
Office: Chemistry Building 205
Tel.: 86-(0)871-65033721
Email: xgxie@ynu.edu.cn
Address: School of Chemical Science and Technology, Yunnan University, 2 North Cuihu Road, 650091 Kunming, P.R.China
Brief Introduction
Professor, Yunnan University (2003 - )
Associate Professor, Yunnan University (1999-2003)
Lecturer, Yunnan University (1994 - 1999)
Assistant, Yichun Normal Training College (1984 - 1991)
Ph.D., Jilin University (1996 - 1999)
M.S., Yunnan University (1991 - 1994)
B.S., Sichuan University (1980 - 1984)
Research Interests
Reaction Mechanism, QSAR, Quantum Chemistry
Foundation and Projects
NSFC 2005091 (2006 - 2008), responsible
NSFC 30930074 (2010 - 2013), participant
Representative Publications
[1] Huiding Xie, Kaixiong Qiu & Xiaoguang Xie，Pharmacophore modeling, virtual screening, and 3D-QSAR studies on a series of non-steroidal aromatase inhibitors, Med. Chem. Res. 2015, 24:1901-1915.
[2] Huiding Xie , Yupeng Li, Fang Yu, Xiaoguang Xie, Kaixiong Qiu and Jijun Fu, An Investigation of Molecular Docking and Molecular Dynamic Simulation on Imidazopyridines as B-Raf Kinase Inhibitors, Int. J. Mol. Sci. 2015, 16, 27350–27361.
[3] Huiding Xie, Kaixiong Qiu & Xiaoguang Xie，3D QSAR Studies, Pharmacophore Modeling and Virtual Screening on a Series of Steroidal Aromatase Inhibitors, Int. J. Mol. Sci. 2014, 15, 20927-20947.
[4] Tao Hong Li, Xiao Guang Xie, “A DFT study on the mechanisms for gas phase reaction of yttrium with propene”，J. Phys. Org. Chem., 2010, 23, 768-775.
[5]Dong-Bao Hu, Xiao-Mei Yang, Li-Feng Yao, Ling-Xia Zhang, Shu-Ye Ma, Shi-Wen Yu, Tao-Hong Li, Xiao-Guang Xie, “Theoretical Study on the Reaction of the 2Δ Ground State of ZrO+ with CS2 in the Gas Phase”, J. Mol. Struct. (THEOCHEM), 2009, 915(1-3), 188-192.
[6]Yin Li-Qin, Yu Shi-Wen, Yao Li-Feng, He Yan-Ping, Xie Xiao-Guang, “QSAR Studies on 6-(1-naphthylmethyl) Substituted S-DABO Derivatives as Novel Non-Nucleoside HIV-1 Reverse Transcriptase Inhibitors”, Chinese J. Struct. Chem. 2008, 27(10), 1214-1222.
[7]Shulin Gao, Xiaoguang Xie, , Juli Xu, “Theoretical study on the reaction of the 2Δ ground state of TiS+ with COS in the gas phase”, Chem. Phys.,2005, 312/1-3, 187-192.
[8]Xiaoguang Xie, A. F. Jalbout, Huai Cao , “Theoretical study on the reaction of the ground state 1Σ+ of ScS+ with oxygen-transfer reagent: ScS++CO2→ScO++COS in the gas phase”, Chem. Phys. Letts., 2004, 386(1-3), 111-117.
[9]Xiaoguang Xie, Song Ye, Shixi Liu, Huai Cao, Nanhua Shi, “Theoretical study on the reaction of the ground state 1Σ+ of MS+ (Sc,Y and La) with oxygen-transfer reagent: MS++CO→MO++CS in the gas phase”, Int. J. Quant. Chem. 2003, 92(6), 478-483.
[10]Xiaoguang Xie, Zhen Wang, Song Ye, Yongming Zhou, Huai Cao, “Theoretical study on the reaction of the ground state 1Σ+ of LaS+ with oxygen-transfer reagent: LaS++H2O→LaO++H2S in the gas phase”, Chem. Phys. Letts. 2002, 354(1-2), 134-139
[11]Xiaoguang Xie, Xuemei Gao, Shixi Liu, Huai Cao Shushan Dai, “The nature of bonding in PtC and PtN”, Chin. Chem. Letts., 2001, 12: 541-544.
[12]Xiaoguang Xie, Xianjun Bi, Huai Cao, Shushan Dai, “The nature of bonding in PtN”, Chin. Chem. Letts., 1998, 9: 687-690.
[13]Xiaoguang Xie, Yuanqi Tao, Huai Cao, Wengui Duan, “Ab initio study of unimolecular pyrolysis mechanisms of dithioformic acid, Chem. Phys.,1996, 213:133-137.
