/tools/RetroBridge

RetroBridge

igashov/RetroBridge

33 stars2 forksPythonAdded February 8, 2026
summary

RetroBridge is a Markov bridge model that facilitates retrosynthesis planning by predicting reactants for given product molecules. It utilizes a generative framework to learn distributions in a discrete state space, achieving state-of-the-art results in retrosynthesis tasks.

description

RetroBridge: Markov Bridge Model for Retrosynthesis Planning

topics

chemistrydrug-designgenerative-modelmarkov-chainretrosynthesismachine-learning

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