Official implementation of the pre-print "Coupled Fragment-Based Generative Modeling with Stochastic Interpolants" by Tuan Le, Yanfei Guan, Djork-Arné Clevert and Kristof T. Schütt.
- Updated
Feb 2, 2026 - Jupyter Notebook
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fragment-based-design
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SynGlue: Generative AI-powered Polypharmacology Toolkit for Decoding and Designing PROTACs
python bioinformatics cheminformatics chemical trie target generative-model drug-discovery rdkit transformer-architecture trie-data-structure generative-modeling transformers-models rdkit-tutorials protacs ai-in-drug-design fragment-based-design
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Mar 20, 2026 - Jupyter Notebook
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