谢小光（博士，教授，博士生导师）

专业：物理化学

主讲课程：本科生《物理化学》、《结构化学》，研究生《量子化学》

团队：材料物理化学研究团队

电话： 0871-65033721

电子信箱：xgxie@ynu.edu.cn

受教育经历及工作经历：

1984年获四川大学理学学士学位

1994 年获云南大学硕士学位

1999年获吉林大学博士学位

1984-1991 年，江西宜春师范专科学校化学系工作

1994-1998年，云南大学现代生物中心工作
1999年至今，云南大学化学科学与工程学院工作。

教学：

主讲《物理化学》

研究领域和兴趣：

应用量子化学

主要兴趣为：化学反应机理理论研究，药物结构与活性定量关系理论研究。

论文、专著：

[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.

科研项目、成果和专利：

1. 过渡金属硫化物阳离子与小分子气相反应动力学理论研究，国家自然科学基金(20050091)，2006.1-2008.12。（负责）

2. 木材用粘合剂共缩聚树脂的应用基础研究，国家自然科学基金重点项目（30930074），2010.1-2013.12。（参与）