COATI: Multimodal Contrastive Pretraining for Representing and Traversing Chemical Space

Benjamin Kaufman, Edward C. Williams, Carl Underkoffler, Ryan Pederson, Narbe Mardirossian, Ian Watson, John Parkhill. COATI: Multimodal Contrastive Pretraining for Representing and Traversing Chemical Space. Journal of Chemical Information and Computer Sciences, 64(4):1145-1157, February 2024. [doi]

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