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RetroGEF2 min read

RetroGEF: Dynamic Graph Edit Flow for Single-Step Retrosynthesis

Retrosynthesis enables the discovery of viable synthetic routes to target molecules. It plays a central role in modern drug discovery and materials design. Retrosynthesis involves molecular graph transformations that can change both connectivity and graph size.

By Xiaozhuang Song, Xuemin Chen, Xinjian Zhao, Yaoyao Xu, Tianshu YuarXiv cs.LG

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Originally published by arXiv cs.LG on Oct 1, 2026.

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