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Data-science driven autonomous process optimization

Melodie Christensen, Lars Yunker, Folarin Adedeji, Florian Häse, Loic Roch, Tobias Gensch, Gabriel dos Passos Gomes, Tara Zepel, Matthew Sigman, Alan Aspuru-Guzik, Jason Hein

Version 2 posted 03 November 2020

2,367

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4

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Catalysis

Review

Spiroindoles as Intermediates/Products in Transition Metal Catalyzed Dearomatization of Indoles

Floris Buttard, Xavier Guinchard

Version 1 posted 06 March 2023

548

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Organic Chemistry

Review

Alcohols as substrates in transition metal-catalyzed arylation, alkylation and related reactions

Adam Cook, Stephen Newman

Version 2 posted 26 March 2024

1,778

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Organic Chemistry

Working Paper

Synthesis of Tetra-ortho-Methoxylated Azobenzene Photoswitches via Sequential Catalytic C−H Activation and Methoxylation

Albert Ruiz-Soriano, Lara Lamelza, Elena Pizzamiglio, Xavier Just-Baringo

Version 1 posted 10 November 2023

740

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Organic Chemistry

Working Paper

Virtual Ligand-Assisted Optimization: A Rational Strategy for Ligand Engineering

Wataru Matsuoka, Taihei Oki, Ren Yamada, Tomohiko Yokoyama, Shinichi Suda, Yu Harabuchi, Satoru Iwata, Satoshi Maeda

Version 1 posted 25 April 2024

247

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Catalysis

Working Paper

Scaling Relations for Ammonia Oxidation

Rachelle Choueiri, Stephen Tatarchuk, Olivia Parker, William Cooper, Leanne Chen

Version 2 posted 18 November 2024

207

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Catalysis

Working Paper

Computational Discovery of Stable Metal-Organic Frameworks for Methane-to-Methanol Catalysis

Husain Adamji, Aditya Nandy, Ilia Kevlishvili, Yuriy Roman-Leshkov, Heather Kulik

Version 1 posted 31 March 2023

647

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Catalysis

Review

Radical Deoxyfunctionalisation Strategies

Khadijah Anwar, Kay Merkens, Francisco José Aguilar Troyano, Adrián Gómez-Suárez

Version 1 posted 21 March 2022

1,238

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Catalysis

Working Paper

Synthesis and Rhodium(I)-Catalyzed Annulative Cleavage of Bicy-clo[1.1.0]butyl Dihydroquinolines and Dihydropyridines

Matteo Borgini, Peter Wipf

Version 1 posted 17 April 2023

708

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9 results in transition metal catalysis in Keywords: transition metal catalysis

Data-science driven autonomous process optimization

Spiroindoles as Intermediates/Products in Transition Metal Catalyzed Dearomatization of Indoles

Alcohols as substrates in transition metal-catalyzed arylation, alkylation and related reactions

Synthesis of Tetra-ortho-Methoxylated Azobenzene Photoswitches via Sequential Catalytic C−H Activation and Methoxylation

Virtual Ligand-Assisted Optimization: A Rational Strategy for Ligand Engineering

Scaling Relations for Ammonia Oxidation

Computational Discovery of Stable Metal-Organic Frameworks for Methane-to-Methanol Catalysis

Radical Deoxyfunctionalisation Strategies

Synthesis and Rhodium(I)-Catalyzed Annulative Cleavage of Bicy-clo[1.1.0]butyl Dihydroquinolines and Dihydropyridines

9 results in Keywords: transition metal catalysis