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组氨酸分子几种稳定构型的手性转变机理及水溶剂化效应 |
王佐成1, 李晨洁2, 董丽荣3, 闫红彦4, 佟华1 |
1. 白城师范学院 物理学院, 吉林 白城 137000; 2. 白城师范学院 传媒学院, 吉林 白城 137000; 3. 吉林师范大学 物理学院, 吉林 四平 136000; 4. 白城师范学院 计算机科学学院, 吉林 白城 137000 |
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Chiral transition mechanism and water solvation effect of stable configurations of histidine molecules |
WANG Zuocheng1, LI Chenjie2, DONG Lirong3, YAN Hongyan4, TONG Hua1 |
1. College of Physics, Baicheng Normal College, Baicheng 137000, Jilin Province, China; 2. College of Media, Baicheng Normal College, Baicheng 137000, Jilin Province, China; 3. College of Physics, Jilin Normal University, Siping 136000, Jilin Province, China; 4. Computer Science College, Baicheng Normal College, Baicheng 137000, Jilin Province, China |
引用本文:
王佐成, 李晨洁, 董丽荣, 闫红彦, 佟华. 组氨酸分子几种稳定构型的手性转变机理及水溶剂化效应[J]. 浙江大学学报(理学版), 2018, 45(1): 103-111,117.
WANG Zuocheng, LI Chenjie, DONG Lirong, YAN Hongyan, TONG Hua. Chiral transition mechanism and water solvation effect of stable configurations of histidine molecules. Journal of ZheJIang University(Science Edition), 2018, 45(1): 103-111,117.
链接本文:
https://www.zjujournals.com/sci/CN/10.3785/j.issn.1008-9497.2018.01.015
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https://www.zjujournals.com/sci/CN/Y2018/V45/I1/103
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[1] 蒋立锐.组氨酸在代谢中的作用[J].生理科学进展,1985,16(2):174-176. JIANG L R. The role of histidine in metabolism[J]. Progress in Physiological Science,1985,16(2):174-176. [2] 叶林奇.组氨酸在蛋白质结构功能中的作用[J].涪陵师专学报,2000,16(4):74-76. YE L Q. The role of histidine in protein structure function[J]. Journal of Fuling Teachers College,2000,16(4):74-76. [3] 胡琼,王国营,欧家鸣,等.组氨酸四种质子化结构振动光谱特性的密度泛函理论计算研究[J].红外,2010,31(2):19-24. HU Q, WANG G Y, OU J M, et al. Calculation of vibrational spectral properties of four protonation forms of histidine using density functional theory[J]. Infrared,2010,31(2):19-24. [4] 王卫宁,李元波,岳伟.组氨酸和精氨酸的太赫兹光谱研究[J].物理学报,2007,56(2):781-785. WANG W N, LI Y B, YUE W. Vibrational spectrum of histidine and arginine in THz range[J]. Acta Physica Sinica,2007,56(2):781-785. [5] 胡琼,王国营,刘刚,等.组氨酸电离能与红外光谱的密度泛涵理论计算研究[J].光谱学与光谱分析,2010,30(5):1192-1197. HU Q, WANG G Y, LIU G, et al. Ionization energies and infrared spectra studies of histidine using density functional theory[J]. Spectroscopy and Spectral Analysis,2010,30(5):1192-1197. [6] 何发虎,毛希安.水溶液中组氨酸的14N NMR研究[J].光谱学杂志,1995,12(2):141-146. HE F H, MAO X A. 14N NMR studies of histidine in aqueous solutions[J]. Chinese Journal of Magnetic Resonance,1995,12(2):141-146. [7] 刘凤阁,闫红彦,王佐成,等.气相赖氨酸分子手性转变机制的理论研究[J].武汉大学学报(理学版),2015,61(1):93-98. LIU F G, YAN H Y, WANG Z C, et al. Theoretical research on chiral change mechanism of gaseous lysine molecules[J]. Journal of Wuhan University(Science Edition),2015,61(1):93-98. [8] 李忠,佟华,王佐成,等.基于氨基作H转移桥梁单体α-Ala的手性转变机理[J].复旦学报(自然科学版),2015,54(5):102-108. LI Z, TONG H, WANG Z C, et al. The chiral transition mechanism of monomer α-Alanine based on amino as H transfer bridge[J]. Journal of Fudan University(Natural Science),2015,54(5):102-108. [9] 王佐成,范志琳,梅泽民,等.半胱氨酸分子手性转变及水分子的催化机理[J].武汉大学学报(理学版),2016,62(4):368-374. WANG Z C, FAN Z L, MEI Z M, et al. Chiral transformation of cysteine molecules and catalytic mechanism of water molecules[J]. Journal of Wuhan University(Science Edition),2016,62(4):368-374. [10] 闫红彦,王佐成,邹晶,等.缬氨酸分子的手性转变及水分子的催化机理[J].中山大学学报(自然科学版),2016,55(2):68-75. YIAN H Y, WANG Z C, ZOU J, et al. Chiral en-antiomers transformation of valine and catalytic mecha-nism of water molecules[J]. Acta Scientiarum Naturalium Universitatis Sunyatseni,2016,55(2):68-75. [11] 黄志坚.氨基酸的构型和性质研究[D].合肥:中国科学技术大学,2006. HUANG Z J. Structures and Properties of the Amino Acids[D]. Hefei:University of Science and Technology of China,2006. [12] BECKE A D. Density-functional thermochemistry Ⅲ-The role of exact exchange[J]. Chem Phys,1993,98(7):5648-5652. [13] PARR R G, YANG W. Density-Functional Theory of Atoms and Molecules[M]. Oxford:Oxford University Press,1994. [14] ALEKSANDR V M, CHRISTOPHER J C, DONALD G T. Universal slovation model based on solute electron density and on a continuum model of the solvent defined by the bulk dielectric constant and atomic surface tensions[J]. J Phys Chem B, 2009,113(18):6378-6396. [15] GARRETT B C, TRUHLAR D G. Generalized transition state theory-Classical mechanical theory and applications to collinear reactions of hydrogen molecules[J]. Journal of Physical Chemistry,1979,83(8):1052-1079. [16] GARRETT B C, TRUHLAR D G. Criterion of minimum state density in the transition state theory of bimolecular reactions[J]. The Journal of Chemical Physics,1979,70(4):1593-1598. [17] GONZALEZ C, SCHLEGEL H. Reaction path following in mass-weighted internal coordinates[J]. Journal of Physical Chemistry,1990,94(14):5523-5527. [18] ISHIDA K, MOROKUMA K, KOMORNICKI A. The intrinsic reaction coordinate. An ab initio calculation for HNC→HCN and H-+ CH4 →CH4+ H-*[J]. The Journal of Chemical Physics,1977,66(5):2153-2156. [19] 徐光宪,黎乐民,王德民.量子化学(中册)[M].北京:科学出版社,1985:962-986. YU G X, LI L M, WANG D M. Quantum Chemistry(Middle)[M]. Beijing:Science Press,1985:962-986. [20] BINKLEY J S, POPLE J A. Moeller- |
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