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Discovering New Chemistry with an Autonomous Robotic Platform Driven by a Reactivity-Seeking Neural Network

Dario Caramelli, Jarosław M. Granda, S. Hessam M. Mehr, Dario Cambié, Alon Henson, Leroy Cronin

Year
2021
Citations
77

Abstract

carbon centers. An analysis reveals that this transformation is intrinsically unpredictable, demonstrating the possibility of a reactivity-first robotic discovery of unknown reaction methodologies without requiring human input.

Keywords

Reactivity (psychology)Chemical spaceReagentComputer scienceChemistryCombinatorial chemistryBiochemical engineeringChemical reactionArtificial neural networkSubstrate (aquarium)

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