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Reaction Atom Mapper & Classifier
Classify, and map atoms between reactants and products in a chemical reaction. Generates atom-mapped reaction SMILES, extracts reaction SMARTS via rdchiral_plus, and classifies the reaction.
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Powered by Agave Chem, our open-source reaction mapping and classification library. Learn more →
What this tool can calculate
- Classify, and map atoms between reactants and products in a chemical reaction
- Generate atom-mapped reaction SMILES with atom map numbers
- Extract reaction SMARTS using rdchiral
- Classify reactions with confidence scores
- Visualize mapped reactions as 2D depictions
- Accept reaction SMILES input or draw reactions with Ketcher