How do we further enhance 2D fingerprint similarity searching for novel drug discovery?
Expert Opin Drug Discov
.
2022 Nov;17(11):1173-1176.
doi: 10.1080/17460441.2022.2128332.
Epub 2022 Sep 27.
Authors
Ingo Muegge
1
,
Yuan Hu
1
Affiliation
1
Alkermes, Inc, Waltham, Massachusetts, USA.
PMID:
36150044
DOI:
10.1080/17460441.2022.2128332
No abstract available
Keywords:
Chemical space; artificial intelligence; machine learning; virtual screening.
Publication types
Editorial
Research Support, Non-U.S. Gov't
MeSH terms
Artificial Intelligence*
Drug Discovery*
Humans