Current and Future Roles of Artificial Intelligence in Medicinal Chemistry Synthesis
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 target molecules. A dat...
Main Authors: | Struble, Thomas J, Jaakkola, Tommi S, Green Jr, William H, Barzilay, Regina |
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Other Authors: | Massachusetts Institute of Technology. Department of Chemical Engineering |
Format: | Article |
Language: | English |
Published: |
American Chemical Society (ACS)
2020
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Online Access: | https://hdl.handle.net/1721.1/125681 |
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