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[会议论文] 作者:Zhang Tingting,Dai Zhenyu, 来源:2014第三届环渤海色谱质谱学术报告会 年份:2014
[期刊论文] 作者:Wang Lixin,Zhou Han,Dai Zhenyu, 来源:中国炼油与石油化工(英文版) 年份:2004
The DFT-based (density functional theory) ab initio quantum mechanical methods have been applied to study the basicity of the nitrogen-containing compounds in p...
[期刊论文] 作者:Fu Xiaoqin,Dai Zhenyu,Tian Son, 来源:中国炼油与石油化工(英文版) 年份:2004
In this paper, the charge distribution, the chemical bond order and the reactive performance of carboxylic acid model compounds on acidic catalyst were investig...
[期刊论文] 作者:Wang Lixin,Zhou Han,Dai Zhenyu, 来源:中国炼油与石油化工:英文版 年份:2009
The DFT-based(density functional theory) ab initio quantum mechanical methods have been applied to study the basicity of the nitrogen-containing compounds i...
[期刊论文] 作者:Fu Xiaoqin,Dai Zhenyu,Tian Son, 来源:中国炼油与石油化工:英文版 年份:2008
在这篇论文,起诉分发,化学契约顺序和羧基的酸的反应表演,酸的催化剂上的模型混合物被使用分子的模拟技术调查。模拟结果比 C-C,和 C-C,契约在有的 carboxyl 激进分子与碳原子连接......
[会议论文] 作者:Yanhui Dai,Zhenyu Wang,Dongmei Gao,Baoshan Xing, 来源:环境毒理与环境化学国际学术研讨会——亚太分会2010年会(SETAC Asia/Pacific2010) 年份:2010
[会议论文] 作者:Dai Zhenyu,Xu Qun,Lina Liang,Jeffrey Rohrer, 来源:第十届全国生物医药色谱及相关技术学术交流会 年份:2014
Glycosylated proteins,including erythropoietins,monoclonal antibodies,various hormones,constitute major approved therapeutic biological drugs.Sialic acid is important to cell recognition and migration...
[会议论文] 作者:Miao Jie,Long Jun,Ren Qiang,Dai Zhenyu, 来源:第四届国际分子模拟大会(The International Conference on Molecular Simula 年份:2016
[会议论文] 作者:Ren Qiang,Zhou Han,Dai Zhenyu,Qu Yakun, 来源:第四届国际分子模拟大会(The International Conference on Molecular Simula 年份:2016
Dissipative particle dynamics(DPD)and Molecular dynamics(MD)and Quantum mechanics(QM)were applied to simulate the asphaltene aggregate structure of heavy oil used MS6.1.The simulations results show th...
[会议论文] 作者:REN Qiang,LONG Jun,DAI Zhenyu,ZHOU Han, 来源:2019中国化学会第十五届全国计算(机)化学学术会议 年份:2019
In order to study the π-π interaction in asphaltene molecular aggregates,quantum mechanical and molecular dynamics methods were used to study the π-π interactions between different molecules forming a...
[期刊论文] 作者:Fu Xiaoqin,Dai Zhenyu,Tian Songbai,Hou Suandi,Wang Xieqing, 来源:中国炼油与石油化工(英文版) 年份:2008
In this paper, the charge distribution, the chemical bond order and the reactive performance of carboxylic acid model compounds on acidic catalyst were investig...
[期刊论文] 作者:Wang Chunlu,Zhou Han,Dai Zhenyu,Zhao Xiaoguang,Zhao Yi,, 来源:China Petroleum Processing & Petrochemical Technology 年份:2013
In order to investigate the influence of hydrogenation degree and structural variety on reaction trend of polyaro- matic hydrocarbons (PAHs) in resins and aspha...
[期刊论文] 作者:Li Na,Long Jun,Zhao Yi,Tao Zhiping,Dai Zhenyu,, 来源:China Petroleum Processing & Petrochemical Technology 年份:2017
Using molecular dynamics simulations based on classical mechanic method, the mechanism of competitive adsorption between gasoline detergent and deposit on Fe(11...
[会议论文] 作者:Li Na,Long Jun,Zhao Yi,Tao Zhiping,Dai Zhenyu, 来源:第四届国际分子模拟大会(The International Conference on Molecular Simula 年份:2016
[会议论文] 作者:Huang Xiongfeng,Xu Qun,Chen Jing,Dai Zhenyu,Jeffrey Rohrer, 来源:第2届大连国际色谱学术报告会、第37届国际高效液相色谱及相关技术会议、第18届全国色谱学术报告会 年份:2011
Caulis Lonicerae is an important traditional Chinese medicine used for the treatment of acute fever, headache, respiratory infection, epidemic diseases, etc.The reported active components in Caulis Lo...
[期刊论文] 作者:Tao Haiqiao,Long Jun,Zhou Han,Xie Chaogang,Dai Zhenyu,Wei Xiaoli, 来源:中国炼油与石油化工(英文版) 年份:2009
The structure and energy of the carbonium ions formed upon protonation of butane were studied by the DFT methods. Four stable structures are identified for the...
[会议论文] 作者:Li Yiya,Long Jun,Duan Qinghua,Dai Zhenyu,Zhao Yi,Su Shuo, 来源:第四届国际分子模拟大会(The International Conference on Molecular Simula 年份:2016
[期刊论文] 作者:Yuan Shuai,Liu Yujian,Tian Huiping,Dai Zhenyu,Zhao Yi,Zhou Han,Long Jun,, 来源:China Petroleum Processing & Petrochemical Technology 年份:2012
The diffusion of C4—C24 alkanes, aromatics and cycloalkanes in FAU and MFI zeolites were studied systematically by molecular simulation. The basic data on diff...
[会议论文] 作者:Yaqi Li,Weixing Dai,Zhenyu Wu,Yang Feng,Ye Xu,Sanjun Cai,Qingguo Li,Guoxiang Cai, 来源:第十届中国医师协会外科医师年会 年份:2017
Purpose Our study aimed to help establish the standard of the minimum number of lymph nodes examined for rectal cancer,by estimating the probability that a pathologically node-negative patients has,in...
[会议论文] 作者:Yiwen Zhang,Jian Zhang,Rong Yan,Jie Zhang,Mengxing Chen,Miao Jiang,Changgeng Ruan,Kesheng Dai,Zhenyu, 来源:The 35th World Congress of the International Society of Hema 年份:2014
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