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Computer-Aided Synthesis Design

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3 results in Keywords: Computer-Aided Synthesis Design

Organometallic Chemistry

A reactivity map for oxidative addition enables quantitative predictions for multiple catalytic reaction classes

Jingru Lu, Sofia Donnecke, Irina Paci, David Leitch

Version 2 posted 26 August 2021

1,227

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Theoretical and Computational Chemistry

A Mechanism to Open Academic Chemistry to High-Throughput Virtual Screening

Corentin Bedart, Grace Shimokura, Frederick G West, Tabitha E Wood, Robert A Batey, John J Irwin, Matthieu Schapira

Version 1 posted 08 December 2023

414

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Theoretical and Computational Chemistry

Synthetically Accessible Virtual Inventory (SAVI)

Hitesh Patel, Wolf Ihlenfeldt, Philip Judson, Yurii S. Moroz, Yuri Pevzner, Megan Peach, Nadya Tarasova, Marc Nicklaus

Version 1 posted 27 April 2020

1,010

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3

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