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Found 2 papers, 1 papers with code
Recent advances in artificial intelligence for retrosynthesis
Afterwards, we analyze these methods in terms of their mechanism and performance, and introduce popular evaluation metrics for them, in which we also provide a detailed comparison among representative methods on several public datasets.
Root-aligned SMILES: A Tight Representation for Chemical Reaction Prediction
Chemical reaction prediction, involving forward synthesis and retrosynthesis prediction, is a fundamental problem in organic synthesis.
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