home/categories/scientific-computing/hxk622-tokendance-backend-app-skills-builtin-scientific-chemistry-molfeat-skill-md
scientific-computingresearch

molfeat

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

hxk622
maintainer
hxk622
Updated 1/19/2026
Stars
1
Forks
0
quick start

Installation and usage

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

Installation
$ install --globalskills.sh
Usage

Once installed, you can use this skill by running the following command in your terminal:

skills use molfeat