SuperMetal: a generative AI framework for rapid and precise metal ion location prediction in proteins

SuperMetal: a generative AI framework for rapid and precise metal ion location prediction in proteins

Abstract Metal ions, as abundant and vital cofactors in numerous proteins, are crucial for enzymatic activities and protein interactions. Given their pivotal role and catalytic efficiency, accurately and efficiently identifying metal-binding sites is fundamental to elucidating their biological funct...

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Bibliographic Details
Main Authors: Xiaobo Lin, Zhaoqian Su, Yunchao Lance Liu, Jingxian Liu, Xiaohan Kuang, Peter T. Cummings, Jesse Spencer-Smith, Jens Meiler
Format: Article
Language:English
Published: BMC 2025-07-01
Series:Journal of Cheminformatics
Subjects:
Generative AI
Diffusion model
Metal-binding sites
Metalloprotein
Online Access:https://doi.org/10.1186/s13321-025-01038-9
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