"Integrating concept of pharmacophore with graph neural networks for ..."

Yue Kong et al. (2022)

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DOI: 10.1186/S13321-022-00634-3

access: open

type: Journal Article

metadata version: 2023-09-30

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  - journals/jcheminf/KongZLYYZWQY22
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  - https://dblp.org/rec/journals/jcheminf/KongZLYYZWQY22
Yue Kong, Xiaoman Zhao, Ruizi Liu, Zhenwu Yang, Hongyan Yin, Bowen Zhao, Jinling Wang, Bingjie Qin, Aixia Yan:
Integrating concept of pharmacophore with graph neural networks for chemical property prediction and interpretation. J. Cheminformatics 14(1): 52 (2022)

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