Developing deep learning-based large-scale organic reaction classification model via sigma-profiles

Advanced technologies like deep learning have accelerated the discovery of novel chemical reactions, especially in the field of organic synthesis. With hundreds of thousands of reactions available for reference, one way to effectively leverage them is by classifying chemical reactions into different...

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Bibliographic Details
Main Authors: Wenlong Wang, Chenyang Xu, Jian Du, Lei Zhang
Format: Article
Language:English
Published: KeAi Communications Co. Ltd. 2025-06-01
Series:Green Chemical Engineering
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Online Access:http://www.sciencedirect.com/science/article/pii/S2666952824000396
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