Molfeat - Molecular Featurization Hub
- **Official Documentation**: https://molfeat-docs.datamol.io/
LLM Evaluation
Evaluated by: xiaomi/mimo-v2-flash:free
Last evaluated: March 29, 2026
Prompt Preview
---
name: molfeat
description: Molecular featurization for ML (100+ featurizers). ECFP, MACCS, descriptors, pretrained models (ChemBERTa), convert SMILES to features, for QSAR and molecular ML.
license: Apache-2.0 license
metadata:
skill-author: K-Dense Inc.
---
# Molfeat - Molecular Featurization Hub
## Overview
Molfeat is a comprehensive Python library for molecular featurization that unifies 100+ pre-trained embeddings and hand-crafted featurizers. Convert chemical structures (SMILES s...
Full prompt length: 14810 characters
Tools & Technologies
- python
- Python