The Open Reaction Database

Chemical reaction data in journal articles, patents, and even electronic laboratory notebooks are currently stored in various formats, often unstructured, which presents a significant barrier to downstream applications, including the training of machine-learning models. We present the Open Reaction...

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Veröffentlicht in:Journal of the American Chemical Society 2021-11, Vol.143 (45), p.18820-18826
Hauptverfasser: Kearnes, Steven M, Maser, Michael R, Wleklinski, Michael, Kast, Anton, Doyle, Abigail G, Dreher, Spencer D, Hawkins, Joel M, Jensen, Klavs F, Coley, Connor W
Format: Artikel
Sprache:eng
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