/tools/MoleculeSTM

MoleculeSTM

chao1224/MoleculeSTM

250 stars24 forksPythonWebsiteAdded February 4, 2026
summary

MoleculeSTM is a multi-modal model designed for text-based editing and retrieval of molecular structures. It provides tools for molecular property prediction and includes datasets for training and evaluation, making it a valuable resource in drug discovery and molecular design.

description

Multi-modal Molecule Structure-text Model for Text-based Editing and Retrieval, Nat Mach Intell 2023 (https://www.nature.com/articles/s42256-023-00759-6)

topics

clipcomputation-chemistrydrug-discoveryeditingpretrainingretrievalfoundation-modelmolecule-editingmoleculeclipmoleculestm

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