kaist-amsg/LocalTransform
Predicting Organic Reactivity with LocalTransform
This tool helps computational chemists and organic synthesis researchers predict the outcomes of organic reactions. You provide details about reactants, and it outputs predictions of the likely products, aiding in reaction planning and synthesis pathway design. It's designed for professionals involved in chemical research and development.
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Use this if you need to accurately predict the products of organic reactions based on reactant inputs, streamlining your synthesis planning.
Not ideal if you are looking for a tool to simulate inorganic reactions or require full quantum mechanical simulations of reaction mechanisms.
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Jupyter Notebook
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Last pushed
Mar 28, 2025
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