/tools/InterRetro

InterRetro

MianchuWang/InterRetro

GitHub
modelgenerationtoolretrosynthesis
4 stars1 forksPythonAdded February 8, 2026
summary

InterRetro is a code repository for a model that facilitates retrosynthesis planning using worst-path policy optimization in tree-structured Markov Decision Processes. It aims to improve the generation of synthetic pathways for molecules, making it a valuable tool in molecular design.

description

Code for NeurIPS 2025 paper "Retrosynthesis Planning via Worst-path Policy Optimisation in Tree-structured MDPs"

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