Drug target affinity prediction based on multi-scale gated power graph and multi-head linear attention mechanism

Shuo Hu; Jing Hu; Xiaolong Zhang; Shuting Jin; Xin Xu

doi:10.1371/journal.pone.0315718

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Open Access

Peer-reviewed

Research Article

Drug target affinity prediction based on multi-scale gated power graph and multi-head linear attention mechanism

Shuo Hu,

Roles Data curation, Investigation, Methodology, Validation, Writing – original draft

Affiliation School of Computer Science and Technology, Wuhan University of Science and Technology, Wuhan, Hubei, China

https://orcid.org/0009-0002-6088-8868

⨯
Jing Hu ,

Roles Formal analysis, Validation, Writing – review & editing

* E-mail: hujing@wust.edu.cn (JH); xiaolong.zhang@wust.edu.cn (XZ)

Affiliations School of Computer Science and Technology, Wuhan University of Science and Technology, Wuhan, Hubei, China, Hubei Province Key Laboratory of Intelligent Information Processing and Real-Time Industrial System, Wuhan, China, Institute of Big Data Science and Engineering, Wuhan University of Science and Technology, Wuhan, Hubei, China
⨯
Xiaolong Zhang ,

Roles Conceptualization, Funding acquisition, Project administration, Writing – review & editing

* E-mail: hujing@wust.edu.cn (JH); xiaolong.zhang@wust.edu.cn (XZ)

Affiliations School of Computer Science and Technology, Wuhan University of Science and Technology, Wuhan, Hubei, China, Hubei Province Key Laboratory of Intelligent Information Processing and Real-Time Industrial System, Wuhan, China, Institute of Big Data Science and Engineering, Wuhan University of Science and Technology, Wuhan, Hubei, China
⨯
Shuting Jin,

Roles Writing – review & editing

Affiliation School of Computer Science and Technology, Wuhan University of Science and Technology, Wuhan, Hubei, China
⨯
Xin Xu

Roles Writing – review & editing

Affiliation School of Computer Science and Technology, Wuhan University of Science and Technology, Wuhan, Hubei, China
⨯

Drug target affinity prediction based on multi-scale gated power graph and multi-head linear attention mechanism

Shuo Hu,
Jing Hu,
Xiaolong Zhang,
Shuting Jin,
Xin Xu

Published: February 21, 2025
https://doi.org/10.1371/journal.pone.0315718

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