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Graph2Edits.zip (194.36 MB)

Retrosynthesis prediction using an end-to-end graph generative architecture for molecular graph editing

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posted on 2023-05-26, 07:02 authored by Weihe Zhong, Ziduo Yang, Calvin Yu-Chian Chen
The USPTO-50k dataset and the trained Graph2Edits model for retrosynthesis prediction.

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