molfeat - Molecular featurization for machine learning
chemistry cheminformatics molecular featurization molecular machine learning
★ 0 · Updated 2026-09-29
Converts SMILES strings or RDKit molecules into fingerprints, descriptors, and pretrained embeddings for molecular machine learning.
⚙ Convert molecular structures to features ⚙ Process molecular batches in parallel ⚙ Load pretrained molecular embeddings