#enantioselectivity — Public Fediverse posts
Live and recent posts from across the Fediverse tagged #enantioselectivity, aggregated by home.social.
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⚛️ 🖥️ Neural network boosts chiral ligand design.
⚗️ Researchers from Yale University and Boehringer Ingelheim Pharmaceuticals have used a neural network to harness the full potential of a small dataset (17 phosphorus ligands) of DFT-calculated molecular features for a Negishi cross-coupling reaction.
https://www.chemistryworld.com/news/neural-network-boosts-chiral-ligand-design/4018008.article
#ChemiVerse #ChemToots #Chemistry #NeuralNetwork #enantioselectivity