Work

Physicochemical graph neural network for learning protein–ligand interaction fingerprints from sequence data

Year: 2024

Type: article

Source: Nature Machine Intelligence

DOI: 10.1038/s42256-024-00847-1

Authors: Huan Yee Koh, Anh T. N. Nguyen, Shirui Pan, Lauren T. May, Geoffrey I. Webb

Institutions: Monash University, Griffith University

Language: English

Topic: Computational Drug Discovery Methods

Subfield: Drug Discovery

Field: Pharmacology, Toxicology and Pharmaceutics

Domain: Life Sciences

Open Access status: green

Funders: Australian Government, Monash University, Australian Research Data Commons, Medical Research Council, National Health and Medical Research Council, Medical Research Future Fund

Award: Positive allosteric modulation of anti-convulsant G protein-coupled receptor signalling to treat drug-resistant epilepsy.

OpenAlex ID: W4399746375

FWCI: 14.68

Cites: 76

Cited by: 111

Related to: 10