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Catalysis

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Organic Chemistry

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Andrew Zahrt

4 results in Authors: Andrew Zahrt

Organic Chemistry

Computational Methods for Training Set Selection and Error Assessment Applied to Catalyst Design: Guidelines for Deciding Which Reactions to Run First and Which to Run Next

Scott Denmark, Andrew Zahrt, William Darrow, Brennan Rose, Jeremy Henle

Version 1 posted 16 November 2020

475

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Development and Validation of a Chemoinformatic Workflow for Predicting Reaction Yield for Pd-Catalyzed C-N Couplings with Substrate Generalizability

N. Ian Rinehart, Rakesh K. Saunthwal, Joël Wellauer, Andrew F. Zahrt, Lukas Schlemper, Alexander S. Shved, Raphael Bigler, Serena Fantasia, Scott E. Denmark

Version 2 posted 13 February 2023

2,200

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1

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Organic Chemistry

Machine Learning-Guided Discovery of New Electrochemical Reactions

Andrew Zahrt, Yiming Mo, Kakasaheb Y. Nandiwale, Ron Shprints, Esther Heid, Klavs Jensen

Version 1 posted 09 September 2022

752

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Chemoinformatic Catalyst Selection Methods for the Optimization of Copper-Bis(oxazoline) Mediated, Asymmetric, Vinylogous Mukaiyama Aldol Reactions

Casey Olen, Andrew Zahrt, Sean Reilly, Danielle Schultz, Khateeta Emerson, David Candito, Neil Strotman, Scott Denmark

Version 2 posted 30 May 2023

983

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2

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