molfeat by k-dense-ai

molfeat

k-dense-ai

18.1k19953 months ago

Molecular featurization for ML (100+ featurizers). ECFP, MACCS, descriptors, pretrained models (ChemBERTa), convert SMILES to features, for QSAR and molecular ML.

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Quick Install
npxskills add k-dense-ai/claude-scientific-skills--skill molfeat
Instructions

No instructions available

Tags & Topics
ai-scientistbioinformaticschemoinformaticsclaudeclaude-skillsclaudecode