Work

Enlarged Data Sets and Innovative Applicability Domain Characterization Empower ML Models to Reliably Bridge hERG Binding Data Gaps in Diverse Chemicals

Year: 2025

Type: article

Source: Chemical Research in Toxicology

DOI: 10.1021/acs.chemrestox.5c00065

Authors: Yuxuan Zhang, Yuwei Liu, Wenjia Liu, Jingwen Chen

Institution: Dalian University of Technology

Language: English

Topic: Computational Drug Discovery Methods

Subfield: Computational Theory and Mathematics

Field: Computer Science

Domain: Physical Sciences

SDG: Good health and well-being

Open Access status: closed

Funders: National Natural Science Foundation of China, National Key Research and Development Program of China

Awards: G3221735096, G8392675128

OpenAlex ID: W4413139703

FWCI: 1.906

Cites: 81

Cited by: 4

Related to: 10