"Multi-instance learning of graph neural networks for aqueous pKa prediction."

Jiacheng Xiong et al. (2022)

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DOI: 10.1093/BIOINFORMATICS/BTAB714

access: open

type: Journal Article

metadata version: 2024-08-04

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Jiacheng Xiong, Zhaojun Li, Guangchao Wang, Zunyun Fu, Feisheng Zhong, Tingyang Xu, Xiaomeng Liu, Ziming Huang, Xiaohong Liu, Kaixian Chen, Hualiang Jiang, Mingyue Zheng:
Multi-instance learning of graph neural networks for aqueous pKa prediction. Bioinform. 38(3): 792-798 (2022)

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