姓名:樊建芬 职称:教授、硕士生导师 部门:化学学院 联系方式: Tel: 86-512-65882890 (Lab) Email: jffan@suda.edu.cn课题组网站 | |
学历及学术经历: 1986、1989和1997年先后获得南京理工大学化学工程专业学士学位、物理化学专业硕士学位以及材料学专业博士学位,同年7月至今在18新利体育
材料与化学化工学部工作,2009年晋升物理化学专业教授。讲授“结构化学”和“量子化学”等课程,2005年度获教学竞赛一等奖,2006年度获“建行奖教金”教学奖。主持国家自然科学基金项目“跨膜环肽纳米管模拟生物水通道的分子动力学研究”(No.21173154)、江苏省教委基金项目“沸石结构和催化机理的QM、MM和MD研究”(No.98KJB150001)和江苏省级重点实验室开放基金“不对称直接羟醛缩合反应QM研究”(No.JSK010),作为主要成员参加国家自然科学基金项目“有机分子在沸石中的吸附、扩散和催化的MM和MD研究”(No.29773021)及973子专题等项目,发表学术论文50多篇。2004和2005年,项目“含能体系结构和性能的理论研究”和“高能体系的理论与实验研究”分别获国防科学技术二等奖(证书号:2004GFJ2185-8)和教育部提名国家科学技术 (自然科学)二等奖(证书号:2004-090)。 研究领域:多肽分子及多肽纳米管结构性能的分子动力学模拟研究,有机合成反应机理的量子化学研究等。 代表写论文: 1. The Relationship between the Permeation-Diffusion Parameters for a Single-file Channel,J. Liu, J. F. Fan*, Chinese Phys. Lett. 2012, in press. 2. The influences of water solvent on the structures and stabilities of Na+–AD conformers, J. F. Fan*, M. Tang, L. G. Qiao, et al. Amino Acids2010, 39, 685. 3. Water diffusion behavior and transportation properties in trans- membrane cyclic hexa-, octa- and deca-peptide nanotubes, J. Liu, J. F. Fan*, M. Tang, et al., J. Phys. Chem. B 2010, 114, 12183. 4. Molecular dynamics simulation for the structure of the water chain in a transmembrane peptide nanotube, J. Liu, J. F. Fan*, M. Tang, et al., J. Phys. Chem. A2010, 114, 2376. 5.Investigation on the micro-mechanisms of Al3+ interfering the reactivities of aspartic acid and its biological processes with Mg2+, J. F. Fan*, L. J. He, J. Liu,J. Mol. Model. 2010, 16 16, 1639. 6. DFT Study on the Role of Methanol Solvent in Morita–Baylis– Hillman Reaction, J. F. Fan*, Ch. H. Yang, L. J. He, Int. J. Quantum Chem. 2009, 109, 1311 7.Theoretical insight into the influences of a-substituents in aliphatic aldehydes on the enantio-selectivities of aldol reactions, J. F. Fan*., L. J. He, Y. P. Sun, Chirality 2008, 20, 54. 8.Poor enantioselectivity of the direct aldol reaction catalyzed by (S,S)-proline dipeptide: a density functional study, J. F. Fan*, L. F. Wu, F. M. Tao, Int. J. Quantum Chem. 2008, 108, 66. 9.DFT study on the origin of the enantioselectivity of (S)-4-hydroxylproline-catalyzed direct aldol reaction between acetone and 4-nitrobenz-aldehyde, J. F. Fan*, L. F. Wu,Y. P. Sun,Chinese J. Chem. 2007, 25, 472. 10. DFT study on the (S)-proline-catalyzed direct aldol reaction between acetone and 4-nitrobenzaldehyde. J. F. Fan*, L. F. Wu, Chinese J. Struct. Chem. 2006, 25(4), 433. 11. AM1 transition state modeling for the enantioselectivities in the chiral oxazaborolidine-catalyzed reductions of α- and β-aminoketones, J. F. Fan*, Y. X. Lu, Q. X. Wang, L. F. Wu, Chinese J. Chem. 2005, 23, 517. 12. Theoretical study on the optical activitities of the final products in the enantioselective reductions of b-aminoketones, J. F. Fan*, Q. X. Wang, Y. X. Lu,J. Mol. Struct. (Theochem) 2004, 674, 49. 13. Concentration dependence of ethene diffusion in H[al]zsm-5 studied by molecular dynamics, J. F. Fan*, Q. X. Wang, X. D. |