Tautomer-Predictor AI Tool Identifies Stable Molecules for Drug Discovery
New York University researchers have trained an AI model to learn chemical patterns associated with stability in drug-like molecules and accurately predict where their hydrogen atoms should be positioned.
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National2 articles from 2 sources across the spectrum· Updated 7d ago
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2 viewpointsAI scans 4.6 million compounds in hours to predict hydrogen positions in drug-like molecules
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