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Drug Discov Today. 2018 Jul;23(7):1373-1384. doi: 10.1016/j.drudis.2018.03.011. Epub 2018 Mar 22.

Can we accelerate medicinal chemistry by augmenting the chemist with Big Data and artificial intelligence?

Author information

1
MedChemica Ltd, Biohub, Alderley Park, Macclesfield SK10 4TG, UK. Electronic address: ed.griffen@medchemica.com.
2
MedChemica Ltd, Biohub, Alderley Park, Macclesfield SK10 4TG, UK.
3
Liverpool John Moores University, School of Pharmacy and Biomolecular Sciences, Liverpool John Moores University, Byrom Street, Liverpool L3 3AF, UK.

Abstract

AI comes to lead optimization: medicinal chemistry in all disease areas can be accelerated by exploiting our pre-competitive knowledge in an unbiased way.

PMID:
29577971
DOI:
10.1016/j.drudis.2018.03.011
[Indexed for MEDLINE]

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