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Physical Chemistry

Working Paper

The Shape of Water in Zeolites and Its Impact on Epoxidation Catalysis

Daniel Bregante, Matthew Chan, Jun Zhi Tan, E. Zeynep Ayla, Christopher P. Nicholas, Diwakar Shukla, David Flaherty

Version 1 posted 26 November 2020

1,421

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Materials Science

Working Paper

Atomic Layer Deposition of CeOx Nanoclusters on TiO2

Ji Liu, Saeed Saedy, Rakshita Verma, J. Ruud van Ommen, Michael Nolan

Version 1 posted 19 May 2020

622

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Inorganic Chemistry

Working Paper

Iron (II/III) Halide Complexes Promote the Interconversion of Nitric Oxide and S-nitrosothiols through Reversible Fe-S Interaction

Anna Poptic, Shiyu Zhang

Version 1 posted 15 February 2021

254

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Catalysis

Working Paper

A Molecular-Level Mechanism of the Biological N2 Fixation

Vanessa Jane Bukas, Jens Kehlet Nørskov

Version 1 posted 25 October 2019

1,463

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3

Citations

Organic Chemistry

Working Paper

A Boron-Oxygen Transborylation Strategy for the Asymmetric Reduction of Ketones

Kieran Nicholson, Joanne Dunne, Peter DaBell, Alexander Beaton Garcia, Andrew D. Bage, Jamie H. Docherty, Thomas A. Hunt, Thomas Langer, Stephen P. Thomas

Version 1 posted 12 June 2020

721

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Catalysis

Working Paper

Migratory Reductive Cross-Coupling via Dual Nickel Metathesis

Yuqiang Li, Binzhi Zhao, Long Peng, Guoyin Yin

Version 1 posted 19 May 2020

1,105

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1

Citations

Theoretical and Computational Chemistry

Working Paper

Quantum Mechanical/Molecular Mechanical investigation of the reduction mechanism of Cysteine Sulfinic acid of Peroxiredoxin via Sulfiredoxin

Hisham Dokainish, James Gauld

Version 1 posted 25 November 2019

446

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Organometallic Chemistry

Working Paper

Intermediacy of Copper(I) under Oxidative Conditions in the Aerobic Copper-Catalyzed Decarboxylative Thiolation of Benzoic Acids

Kerry-Ann Green, Jessica Hoover

Version 1 posted 27 September 2019

576

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Theoretical and Computational Chemistry

Working Paper

Computational Approach Choice in Modeling Flexible Enzyme Active Sites

Hisham Dokainish, James Gauld

Version 1 posted 25 November 2019

377

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Organic Chemistry

Working Paper

Electrochemically Driven, Ni-Catalyzed Aryl Amination: Scope, Mechanism, and Applications

Yu Kawamata, Julien Vantourout, David P. Hickey, Peng Bai, Longrui Chen, Qinglong Hou, Wenhua Qiao, Koushik Barman, Martin A. Edwards, Alberto F. Garrido-Castro, Justine N. deGruyter, Hugh Nakamura, Kyle W. Knouse, Chuanguang Qin, Khalyd J. Clay, Denghui Bao, Chao Li, Jeremy T. Starr, Carmen N. Garcia-Irizarry, Neal Sach, Henry S. White, Matthew Neurock, Shelley D. Minteer, Phil Baran

Version 1 posted 28 February 2019

1,326

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Refine Search

126 results in mechanism in Keywords: mechanism

The Shape of Water in Zeolites and Its Impact on Epoxidation Catalysis

Atomic Layer Deposition of CeOx Nanoclusters on TiO2

Iron (II/III) Halide Complexes Promote the Interconversion of Nitric Oxide and S-nitrosothiols through Reversible Fe-S Interaction

A Molecular-Level Mechanism of the Biological N2 Fixation

A Boron-Oxygen Transborylation Strategy for the Asymmetric Reduction of Ketones

Migratory Reductive Cross-Coupling via Dual Nickel Metathesis

Quantum Mechanical/Molecular Mechanical investigation of the reduction mechanism of Cysteine Sulfinic acid of Peroxiredoxin via Sulfiredoxin

Intermediacy of Copper(I) under Oxidative Conditions in the Aerobic Copper-Catalyzed Decarboxylative Thiolation of Benzoic Acids

Computational Approach Choice in Modeling Flexible Enzyme Active Sites

Electrochemically Driven, Ni-Catalyzed Aryl Amination: Scope, Mechanism, and Applications

126 results in Keywords: mechanism