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Sponsored Artificial Intelligence: A Modern Approach, Global Edition Artificial Intelligence: A Modern Approach, Global Edition

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James Mulcahey

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Open access Aug 2026

Predicting Activation Barriers With Ring and Bond Critical Points in the Kemp Elimination Reaction.

The Kemp elimination reaction can be catalyzed by computationally designed enzymes. After undergoing directed evolution, changes to the positioning of active site residues in Kemp eliminases can alter electric fields (EFs) and improve catalytic efficiency. However, optimizing EFs during the enzyme design process remain...

H. Redmon, Katie H. Ly, James Mulcahey et al. · 0 citations

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