DFT study on addition reaction mechanism of guanine-cytosine base pair with OH radical

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Author(s):  
Minjie Li ◽  
Ling Diao ◽  
Xiaofei Liao ◽  
Li Kou ◽  
Wencong Lu
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Reaction Mechanism ◽  
Base Pair ◽  
Addition Reaction ◽  
Dft Study ◽  
Oh Radical

scholarly journals DFT Study on Reaction Mechanism of DNA Base Pair with Hydroxyl Radical

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Eisuke Shimizu ◽  
Ryota Hoshino ◽  
Kazuya Nomura ◽  
Victor I. Danilov ◽  
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Reaction Mechanism ◽  
Hydroxyl Radical ◽  
Base Pair ◽  
Dft Study ◽  
Dna Base ◽  
Dna Base Pair

DFT study of adenine-uracil base pair damage by OH radical

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pp. 645-651 ◽  
Author(s):  
Xiaofei Liao ◽  
Ling Diao ◽  
Li Kou ◽  
Zhonggao Li ◽  
Minjie Li ◽  
...  
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Base Pair ◽  
Dft Study ◽  
Oh Radical ◽  
Uracil Base

DFT study on abstraction reaction mechanism of oh radical with 2-methoxyphenol

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Keyword(s):  
Reaction Mechanism ◽  
Dft Study ◽  
Oh Radical ◽  
Abstraction Reaction

Relativistic DFT Study on the Reaction Mechanism of Second-Row Transition Metal Ru with CO2

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Vol 110 (10) ◽  
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Xian-Yang Chen ◽  
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Keyword(s):  
Reaction Mechanism ◽  
Transition Metal ◽  
Dft Study ◽  
Relativistic Dft

Carbonylative Cycloaddition of Allyl Halides and Acetylenes Promoted by Ni(CO)4. A DFT Study on the Reaction Mechanism

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Carles Bo ◽  
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Reaction Mechanism ◽  
Dft Study ◽  
Allyl Halides

scholarly journals The C-H Bond Dissociation Enthalpies and Estimation of the Kinetics of Hydrogen Abstraction by OH radical for Fluorinated Formates: A DFT Study

2001 ◽  
Vol 2 ◽  
pp. 45-51 ◽  
Author(s):  
Shingo Urata ◽  
Tadafumi Uchimaru ◽  
Asit K. Chandra ◽  
Akira Takada ◽  
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Dft Study ◽  
Oh Radical ◽  
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scholarly journals Theoretical study on Reaction Mechanism of methylene amidogen H2CN with OH radical

2020 ◽  
Vol 545 ◽  
pp. 012023
Author(s):  
Jing-Lin Pang ◽  
Yue-Mei Wang ◽  
Xian-Ming Zhang ◽  
Yu-Peng Hua ◽  
Zhen Wu ◽  
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Keyword(s):  
Reaction Mechanism ◽  
Theoretical Study ◽  
Oh Radical

scholarly journals Uncatalyzed conjugate addition of organozinc halides to enones in DME: a combined experimental/computational study on the role of the solvent and the reaction mechanism

2020 ◽  
Vol 11 (1) ◽  
pp. 257-263 ◽  
Author(s):  
Gianluca Casotti ◽  
Gianluca Ciancaleoni ◽  
Filippo Lipparini ◽  
Chiara Nieri ◽  
Anna Iuliano
Keyword(s):  
Reaction Mechanism ◽  
Addition Reaction ◽  
Computational Study ◽  
Conjugate Addition

The reaction mechanism of a new conjugate addition reaction of organozinc halides to enones is disclosed by a combined experimental/computational study.

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