Organization ranking
Snapshot:
- Poland rank
- #172
- Top repository
- MLCIL/scikit-fingerprints
GitHub
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Snapshot:
Scikit-learn compatible library for molecular fingerprints and chemoinformatics
Code for the article "Benchmarking Pretrained Molecular Embedding Models For Molecular Representation Learning" https://arxiv.org/abs/2508.06199
PyMC port of Bayesian Bradley-Terry model for multi-algorithm multi-dataset comparison
MolPILE - large-scale, diverse dataset for molecular representation learning, https://arxiv.org/abs/2509.18353, https://huggingface.co/datasets/scikit-fingerprints/MolPILE
Code for paper "Molecular Fingerprints Are Strong Models for Peptide Function Prediction" https://arxiv.org/abs/2501.17901
mlcil.org