MIT Open Access Articles: Recent submissions
Now showing items 445-447 of 55784
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Multitask methods for predicting molecular properties from heterogeneous data
(AIP Publishing, 2024-07-03)Data generation remains a bottleneck in training surrogate models to predict molecular properties. We demonstrate that multitask Gaussian process regression overcomes this limitation by leveraging both expensive and cheap ... -
Automated Flow Synthesis of Artificial Heme Enzymes for Enantiodivergent Biocatalysis
(American Chemical Society, 2025-01-22)The remarkable efficiency with which enzymes catalyze small-molecule reactions has driven their widespread application in organic chemistry. Here, we employ automated fast-flow solid-phase synthesis to access catalytically ... -
Development of a Ligand for Cu-Catalyzed Amination of Base-Sensitive (Hetero)aryl Chlorides
(American Chemical Society, 2025-10-13)We report a new N1,N2-diarylbenzene-1,2-diamine ligand, L6, that supports a copper catalyst capable of coupling base-sensitive aryl chlorides and amines that were previously unsuccessful substrates for Cu-catalyzed C–N ...
