/tools/MultiStepRetrosynthesisTTL
MultiStepRetrosynthesisTTL
reymond-group/MultiStepRetrosynthesisTTL
27 stars6 forksPythonAdded February 8, 2026
summary
MultiStepRetrosynthesisTTL is a tool designed for predicting multistep retrosynthesis routes by utilizing a disconnection aware triple transformer loop approach. It integrates various models to enhance the prediction of synthetic pathways, making it a valuable resource for molecular design and synthesis in computational chemistry.
description
Multi-Step Retrosynthesis Tool based on Augmented Disconnection Aware Triple Transformer Loop Predictions
topics
chemistryretrosynthesisretrosynthesis-reaction-pathwaysynthesistransformer-architecturebiocatalysis
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