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Automated Discovery of Complex Reaction Networks: Reaction Topology, Thermochemistry and Kinetics.

机译：复杂反应网络的自动发现：反应拓扑，热化学和动力学。

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作者
Zheng, S.; Pfaendtner, W.;
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年度 2015
页码 1-14
总页数 14
原文格式 PDF
正文语种 eng
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关键词
Jet engine fuels; Combustion; Chemical reactions; Thermochemistry; Oxidation; Air flow; High temperature; Kinetics;

机译：喷气发动机燃料;燃烧;化学反应;热化学;氧化;空气流动;高温;动力学;

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1. Copper(Ⅰ) 1,2,4-Triazolates and Related Complexes: Studies of the Solvothermal Ligand Reactions, Network Topologies, and Photoluminescence Properties [J] . Jie-Peng Zhang, Yan-Yong Lin, Xiao-Chun Huang, Journal of the American Chemical Society . 2005,第15期

机译：1,2,4-三唑酸铜（Ⅰ）及相关配合物：溶剂热配体反应，网络拓扑和光致发光性质的研究
2. Performance of ACE-Reaction on 26 Organic Reactions for Fully Automated Reaction Network Construction and Microkinetic Analysis [J] . Kim Jin Woo, Kim Yeonjoon, Baek Kyung Yup, The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2019,第22期

机译：ACE反应对26例有机反应的性能，用于全自动反应网络施工和微因分析
3. Impact of reducing agent, temperature, and substrate topology on diastereoselectivity of the intermolecular coupling reactions, or how "free" are cobalt-complexed propargyl radicals? [J] . Melikyan G.G., Carlson L., Sahakyan N., Dalton transactions: An international journal of inorganic chemistry . 2013,第41期

机译：还原剂，温度和底物拓扑结构对分子间偶联反应的非对映选择性的影响，或者钴络合的炔丙基自由基的“游离度”如何？
4. Discovery of environmentally benign synthetic reactions catalyzed by pincer complexes [C] . David Milstein Process Development Symposium . 2013

机译：发现钳子复合物催化的环境良性合成反应
5. Investigation of the thermochemistry and photochemistry of terminally disubstituted Fischer chromium carbene complexes, transition structures of the electrocyclization reactions of dienylcumulenes and virtual office hours: Facilitating faculty-student communication [D] . Walker, Matthew Joseph 1997

机译：末端二取代的费希尔铬卡宾配合物的热化学和光化学研究，二烯基枯烯的电环化反应的过渡结构和虚拟办公时间：促进师生沟通
6. Automated reaction database and reaction network analysis: extraction of reaction templates using cheminformatics [O] . Pieter P. Plehiers, Guy B. Marin, Christian V. Stevens, 2018

机译：自动化反应数据库和反应网络分析：使用化学信息学提取反应模板
7. Copper(I) 1, 2, 4-Triazolates and Related Complexes: Studies of the Solvothermal Ligand Reactions, Network Topologies, and Photoluminescence Properties [O] . -1

机译：铜（I）1,2,4-三唑类及相关综合物：研究溶剂热配体反应，网络拓扑和光致发光性能

Automated Discovery of Complex Reaction Networks: Reaction Topology, Thermochemistry and Kinetics.

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