Work

ChargeNet: E(3) Equivariant Graph Attention Network for Atomic Charge Prediction

Year: 2025

Type: article

Source: Journal of Chemical Information and Modeling

DOI: 10.1021/acs.jcim.5c00602

Authors: Qiaolin Gou, Qun Su, Jike Wang, Hui Zhang, Huiyong Sun, Xujun Zhang, Linlong Jiang, Meijing Fang, Yu Kang, Huanxiang Liu, Tingjun Hou, Chang-Yu Hsieh

Institutions: Macao Polytechnic University, Zhejiang University, China Pharmaceutical University

Language: English

Topic: Computational Drug Discovery Methods

Subfield: Computational Theory and Mathematics

Field: Computer Science

Domain: Physical Sciences

Open Access status: closed

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

Awards: G2627715752, G7923530440, G8046587924

OpenAlex ID: W4411420215

FWCI: 0.479

Cites: 45

Cited by: 1

Related to: 10