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Novel N-chloramine precursors for antimicrobial application: synthesis and facile covalent immobilization on polyurethane surface based on perfluorophenyl azide (PFPA) chemistry 期刊论文
CANADIAN JOURNAL OF CHEMISTRY, 2018, 卷号: 96, 期号: 10, 页码: 939-948
Authors:  Li, Lingdong;  Zhang, Fengxiang;  Gai, Fangyuan;  Zhou, Hao;  Chi, Xiaofang;  Wang, Hande;  Zhao (Kent), Zongbao
Favorite  |  View/Download:9/0  |  Submit date:2019/06/20
N-chloramine antibacterial agents  organic synthesis  perfluorophenyl azide chemistry  polyurethane surface modification  
Elaborating a new excited state intramolecular proton transfer (ESPT) mechanism for a new pi-conjugated dye 2,2'-((5-(2-(4-methoxyphenyl) ethenyl)-benzene-1,1-diyl)-bis-(nitrilomethylylidene)-diphenol) 期刊论文
CANADIAN JOURNAL OF CHEMISTRY, 2018, 卷号: 96, 期号: 3, 页码: 351-357
Authors:  Yang, Dapeng;  Jia, Min;  Song, Xiaoyan;  Zhang, Qiaoli
Favorite  |  View/Download:2/0  |  Submit date:2019/06/20
Esipt  Aim  Mos  Potential Energy Surfaces  
A theoretical investigation on excited-state single or double proton transfer process for aloesaponarin I 期刊论文
CANADIAN JOURNAL OF CHEMISTRY, 2018, 卷号: 96, 期号: 1, 页码: 83-88
Authors:  Wei, Qiang;  Wang, Jiyu;  Zhao, Meiyu;  Zhang, Meixia;  Song, Yuzhi;  Song, Peng
Favorite  |  View/Download:6/0  |  Submit date:2019/06/20
Proton Transfer  Intramolecular Hydrogen Bond  Pes  Frontier Molecular Orbital  
An analogy study on ESIPT reaction for 3BHC sensor between polar DMF and nonpolar toluene 期刊论文
CANADIAN JOURNAL OF CHEMISTRY, 2017, 卷号: 95, 期号: 12, 页码: 1303-1307
Authors:  Yang, Dapeng;  Jia, Min;  Wu, Jingyuan;  Song, Xiaoyan;  Zhang, Qiaoli
Favorite  |  View/Download:34/0  |  Submit date:2017/12/19
Hydrogen Bond  Esipt  Potential Energy Curves  
An analogy study on ESIPT reaction for 3BHC sensor between polar DMF and nonpolar toluene 期刊论文
CANADIAN JOURNAL OF CHEMISTRY, 2017, 卷号: 95, 期号: 12, 页码: 1303-1307
Authors:  Yang, Dapeng;  Jia, Min;  Wu, Jingyuan;  Song, Xiaoyan;  Zhang, Qiaoli
Favorite  |  View/Download:50/0  |  Submit date:2017/12/19
Hydrogen Bond  Esipt  Potential Energy Curves  
Collision time of a triatomic chemical reaction A + BC 期刊论文
Canadian Journal of Chemistry, 2016, 卷号: 93, 期号: 0, 页码: 607
Authors:  He XH(和小虎);  Victor Wei-Keh Chao (Wu);  Han KL(韩克利);  Ce Hao;  Zhang Y(张岩)
Favorite  |  View/Download:42/0  |  Submit date:2016/11/24
Collision time of a triatomic chemical reaction A plus BC 期刊论文
CANADIAN JOURNAL OF CHEMISTRY, 2015, 卷号: 93, 期号: 6, 页码: 607-614
Authors:  He, Xiaohu;  Chao (Wu), Victor Wei-Keh;  Han, Keli;  Hao, Ce;  Zhang, Yan
Favorite  |  View/Download:76/0  |  Submit date:2015/11/17
Collision Time  Total Distance  Reactive Probability Distribution  Direct And inDirect Reaction  
Stereodynamics investigation of F plus HO -> HF + O(D-1) on the ground singlet potential energy surface by means of the quasi-classical trajectory method 期刊论文
CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 2014, 卷号: 92, 期号: 3, 页码: 250-256
Authors:  Zhao, Dan;  He, Xiaohu;  Guo, Wei
Favorite  |  View/Download:29/0  |  Submit date:2015/11/17
Stereodynamics  Quasi-classical Trajectory  Collision Energy  Isotopic Effect  Initial Ro-vibrational Excitation  
QM/MM MD and free energy simulations of the methylation reactions catalyzed by protein arginine methyltransferase PRMT3 期刊论文
CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 2013, 卷号: 91, 期号: 7, 页码: 605-612
Authors:  Chu, Yuzhuo;  Li, Guohui;  Guo, Hong
Favorite  |  View/Download:16/0  |  Submit date:2015/11/09
Protein Arginine Methyltransferases  Product Specificity  Qm/mm  Md And Free Energy Simulations  Reaction Mechanism  
QM/MM MD and free energy simulations of the methylation reactions catalyzed by protein arginine methyltransferase PRMT3 期刊论文
CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 2013, 卷号: 91, 期号: 7, 页码: 605-612
Authors:  Chu, Yuzhuo;  Li, Guohui;  Guo, Hong
Favorite  |  View/Download:18/0  |  Submit date:2015/11/09
Protein Arginine Methyltransferases  Product Specificity  Qm/mm  Md And Free Energy Simulations  Reaction Mechanism