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reaction-informatics

Here are 3 public repositories matching this topic...

MolecularAI / aizynthfinder

A tool for retrosynthetic planning

cheminformatics neural-networks monte-carlo-tree-search chemical-reactions astrazeneca reaction-informatics

Updated Dec 9, 2025
Python

TieuLongPhan / SynKit

Toolkit for synthesis planning

rule-based-modeling graph-transformation reaction-informatics reaction-modeling

Updated Dec 15, 2025
Python

TieuLongPhan / SynUtils

Utils for synthesis planning

visualization synthesis reaction-informatics reaction-modeling

Updated Mar 21, 2025
Python

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