Machine learning for active sites prediction of quinoline derivatives

Privileged structures, like quinoline, have diverse biological activities, and their synthetic versatility makes them crucial for drug design. In traditional synthesis methods, the C-H functionalization of quinoline can be effectively achieved using different conditions, especially transition metal...

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Bibliographic Details
Main Authors: Jie Sun, Zi-Hao Li, Yi-Fei Yang, Shu-Yu Zhang
Format: Article
Language:English
Published: Elsevier 2025-06-01
Series:Artificial Intelligence Chemistry
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Online Access:http://www.sciencedirect.com/science/article/pii/S294974772400040X
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