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Fundamental Reaction Pathway and Free Energy Profile for Inhibition of Proteasome by Syringolin A (S
[会议论文] 作者:Donghui Wei,Chang-Guo Zhan,
来源:第十二届全国量子化学会议 年份:2014
Based on our previous work,[1,2] the molecular dynamics simulations and first-principles quantum mechanical/molecular mechanical free energy calculations(QM/MM-FE)have been performed to provide the de...
[会议论文] 作者:Donghui Wei,Chang-Guo Zhan,
来源:第十三届全国量子化学会议 年份:2017
First-principles quantum mechanical/molecular mechanical(QM/MM)-free energy calculations1-4 have been performed to uncover how uricase catalyzes metabolic reactions of uric acid(UA),demonstrating that...
Cooperation of SET and CMD mechanisms of cobalt-catalyzed dual C-H activation and cross-coupling rea
[会议论文] 作者:Xue Li,Donghui Wei,Zhongjun Li,
来源:第十三届全国量子化学会议 年份:2017
Almost all the Co-catalyzed C - H functionalizations have been achieved based on either single electron transfer(SET)or the concerted-metalation deprotonati...
[会议论文] 作者:Xiaokang Guo,Donghui Wei,Mingsheng Tang,
来源:第十二届全国量子化学会议 年份:2014
Based on our previous work,[1,2,3,4] the computational study on the detailed mechanism of NHC-catalyzed enantioselective [4+2] annulation of oxidized enals and azodicarboxylates[5](Scheme 1)has been p...
Insights into the NHC-catalyzed Enantioselective and Chemoselective α-Fluorination of Aliphatic Alde
[会议论文] 作者:Yang Wang,Mingsheng Tang,Donghui Wei,
来源:第十三届全国量子化学会议 年份:2017
Based on the Wangs experiment,1 the reaction mechanism,stereoselectivity,and chemoselectivity on oxidative α-fluorination of aliphatic aldehydes via α C(sp3)-H activation enabled by N-heterocyclic car...
Cooperation of SET and CMD mechanisms of cobalt-catalyzed dual C-H activation and cross-coupling rea
[会议论文] 作者:Xue Li,Donghui Wei,Zhongjun Li,
来源:第十三届全国量子化学会议 年份:2017
Almost all the Co-catalyzed C - H functionalizations have been achieved based on either single electron transfer(SET)or the concerted-metalation deprotonation(CMD)mechanism.[1-2] Recently,Du et al....
[会议论文] 作者:Linjie Zheng,Yanyan Wang,Donghui Wei,
来源:河南省化学会2016年学术年会 年份:2016
N-heterocyclic carbene catalyzed enantioselective cascade reaction of enals has been developed with significant progress in recent years,but the mechanisms of these kinds of reactions are poorly under...
[会议论文] 作者:Wenjing Zhang,Donghui Wei,Yanyan Zhu,Mingsheng Tang,
来源:第十一届全国量子化学会议 年份:2011
...
Insights into Chemoselective Fluorination Reaction of Alkynals via N-Heterocyclic Carbene and Br(o)n
[会议论文] 作者:Wei Zhang,Yang Wang,Donghui Wei,Mingsheng Tang,
来源:第十三届全国量子化学会议 年份:2017
In 2016,Wang and co-authors reported the catalytic α-fluoroallenoate synthesis via N-heterocyclic carbene-catalyzed fluorination reaction of alkynals[1]....
Theoretical study on the reaction of 1,3-dialkynes with ammoniaderivatives for the formation of five
[会议论文] 作者:Yanyan Wang,Yang Wang,Donghui Wei,Mingsheng Tang,
来源:第十二届全国量子化学会议 年份:2014
Recently,Baos group have reported the synthesis of 3,5-disubstituted pyrazole and 3,5-disubstituted isoxazoles in excellent yields.[1,2] In this work,we aim to disclose the detailed mechanism for the...
Insights into Chemoselective Fluorination Reaction of Alkynals via N-Heterocyclic Carbene and Br(o)n
[会议论文] 作者:Wei Zhang,Yang Wang,Donghui Wei,Mingsheng Tang,
来源:第十三届全国量子化学会议 年份:2017
In 2016,Wang and co-authors reported the catalytic α-fluoroallenoate synthesis via N-heterocyclic carbene-catalyzed fluorination reaction of alkynals[1]....
Theoretical investigation toward the organophosphine-catalyzed [3+3] annulation reaction of carbonat
[会议论文] 作者:Yang Wang,Xue Li,Donghui Wei,Mingsheng Tang,
来源:河南省化学会2016年学术年会 年份:2016
The detailed mechanisms and stereoselectivity of the chiral phosphine-catalyzed C(sp2)-H activation/[3+3] cycloaddition cascade reaction between Morita-Baylis-Hillman(MBH)carbonates and C,N-cyclic azo...
Reaction mechanisms of N-heterocyclic carbene-catalyzed [2+3] cyclocondensation of α-chloroaldehydes
[会议论文] 作者:Zhenhua Zhu,Donghui Wei,Yanyan Zhu,Mingsheng Tang,
来源:河南省化学会2016年学术年会 年份:2016
...
A DFT study on the mechanisms of the SN2 reaction at phosphour between different chlorinated spiroph
[会议论文] 作者:Yanyan Wang,Yang Wang,Yanyan Zhu,Donghui Wei,Mingsheng Tang,
来源:河南省化学会2014年学术年会 年份:2014
...
A DFT study on the mechanisms of the SN2 reaction at phosphour between different chlorinated spiroph
[会议论文] 作者:Yanyan Wang,Yang Wang,Yanyan Zhu,Donghui Wei,Mingsheng Tang,
来源:河南省化学会2014年学术年会 年份:2014
Bimolecular nucleophilic substitution (SN2) reaction is ubiquitous in chemistry[1].Compared to the extensive research on the SN2 process at carbon and nitrogen,the displacement at phosphorus,denoted a...
The active structure, catalytic activity and self-cycle mechanism of tungsten peroxo complexes for t
[会议论文] 作者:Peng Jin,Donghui Wei,Yiqiang Wen,Huijuan Wei,Mingsheng Tang,Xiangyu Wang,
来源:第十五届全国催化学术会议 年份:2010
...
The active structure, catalytic activity and self-cycle mechanism of tungsten peroxo complexes for t
[会议论文] 作者:Peng Jin,Donghui Wei,Yiqiang Wen,Huijuan Wei,Mingsheng Tang,Xiangyu Wang,
来源:第十五届全国催化学术会议 年份:2010
...
A mitochondrial-targeted ratiometric probe for detecting intracellular H_(2)S with high photostabili
[期刊论文] 作者:Dandan Bu,Yuying Wang,Na Wu,Wei Feng,Donghui Wei,Zhanxian Li,Mingming Yu,
来源:中国化学快报:英文版 年份:2021
Based on 4-bromo-1,8-naphthalic anhydride,one novel ratiometric fluorescence H2S-probe(IDNA)was designed and synthesized.Further studies indicate that IDNA can sensitively recognize H2S(detection limit of 7 μmol/L)with good selectivi...
[期刊论文] 作者:Dandan Bu,Yuying Wang,Na Wu,Wei Feng,Donghui Wei,Zhanxian Li,Mingming Yu,
来源:中国化学快报(英文版) 年份:2004
Based on 4-bromo-1,8-naphthalic anhydride,one novel ratiometric fluorescence H2S-probe(IDNA)was designed and synthesized.Further studies indicate that IDNA can...
[会议论文] 作者:Xue Li,Yue Li,Hao Xu,Xuchen Shang,Donghui Wei,Wenjing Zhang,Yanyan Zhu,Mingsheng Tang,
来源:河南省化学会2016年学术年会 年份:2016
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