Current and Future Roles of Artificial Intelligence in Medicinal Chemistry Synthesis

[Image: see text] Artificial intelligence and machine learning have demonstrated their potential role in predictive chemistry and synthetic planning of small molecules; there are at least a few reports of companies employing in silico synthetic planning into their overall approach to accessing targe...

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שמור ב:
מידע ביבליוגרפי
הוצא לאור ב:J Med Chem
Main Authors: Struble, Thomas J., Alvarez, Juan C., Brown, Scott P., Chytil, Milan, Cisar, Justin, DesJarlais, Renee L., Engkvist, Ola, Frank, Scott A., Greve, Daniel R., Griffin, Daniel J., Hou, Xinjun, Johannes, Jeffrey W., Kreatsoulas, Constantine, Lahue, Brian, Mathea, Miriam, Mogk, Georg, Nicolaou, Christos A., Palmer, Andrew D., Price, Daniel J., Robinson, Richard I., Salentin, Sebastian, Xing, Li, Jaakkola, Tommi, Green, William. H., Barzilay, Regina, Coley, Connor W., Jensen, Klavs F.
פורמט: Artigo
שפה:Inglês
יצא לאור: American Chemical Society 2020
גישה מקוונת:https://ncbi.nlm.nih.gov/pmc/articles/PMC7457232/
https://ncbi.nlm.nih.gov/pubmed/32243158
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jmedchem.9b02120
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