sk Skill · tassiovale
molfeat
Molecular featurization for ML (100+ featurizers). ECFP, MACCS, descriptors, pretrained models (ChemBERTa), convert SMILES to features, for QSAR and molecular ML.
Open on skills.sh ↗read 2026-09-15
- installs 8w
- 0
- 30-day movement
- starts with the next reading
- Related entries
- 4
- Connections
- 1
pythonbashPython
- Host repository
- tassiovale/claude-code-kit
- Version
- 1.0
- Allowed tools
- Read Write Edit Bash
- Compatible with
- Requires Python 3.9–3.10 (molfeat 0.11.0 does not support 3.11+). Requires datamol, PyTorch, and optional extras for GNN/transformer models.
- Licence
- Apache-2.0 license
- Host stars
- 13
- Host language
- Python