Machine learning models to predict ligand binding affinity for the orexin 1 receptor

Machine learning models to predict ligand binding affinity for the orexin 1 receptor

The orexin 1 receptor (OX1R) is a G-protein coupled receptor that regulates a variety of physiological processes through interactions with the neuropeptides orexin A and B. Selective OX1R antagonists exhibit therapeutic effects in preclinical models of several behavioral disorders, including drug se...

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Bibliographic Details
Main Authors: Vanessa Y. Zhang, Shayna L. O’Connor, William J. Welsh, Morgan H. James
Format: Article
Language:English
Published: Elsevier 2024-06-01
Series:Artificial Intelligence Chemistry
Subjects:
Hypocretin
Orexin
Hypothalamus
Machine learning
Random forest
Feature selection
Online Access:http://www.sciencedirect.com/science/article/pii/S2949747723000404

Internet

http://www.sciencedirect.com/science/article/pii/S2949747723000404

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