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AI scans 4.6 million compounds in hours to predict hydrogen positions in drug-like molecules

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  2. Cea mai nouăacum 15 h

    New AI tool predicts hydrogen positions to speed up 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.

    TMThe Medical News
  3. Prima relatareacum 18 h

    AI scans 4.6 million compounds in hours to predict hydrogen positions in drug-like molecules

    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.

    Phys.orgPhys.org