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scikit-fingerprints

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https://github.com/scikit-fingerprints/scikit-fingerprints
scikit-fingerprints
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Recent Activity

morgul10  updated a dataset 6 days ago
scikit-fingerprints/LRGB_Peptides-struct
morgul10  updated a dataset 6 days ago
scikit-fingerprints/LRGB_Peptides-func
kacperszo  updated a dataset about 1 month ago
scikit-fingerprints/litmus
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Jakub Adamczyk's profile picturepiotr's profile pictureMateusz P's profile pictureKacper Szot's profile pictureMaciek's profile picture

models 0

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datasets 82

scikit-fingerprints/LRGB_Peptides-struct

Viewer • Updated 6 days ago • 15.5k • 562

scikit-fingerprints/LRGB_Peptides-func

Viewer • Updated 6 days ago • 15.5k • 549

scikit-fingerprints/litmus

Preview • Updated Feb 12 • 609

scikit-fingerprints/MolPILE

Viewer • Updated Nov 3, 2025 • 238M • 194 • 2

scikit-fingerprints/MoleculeACE_chembl4792_ki

Viewer • Updated Oct 15, 2025 • 1.47k • 55

scikit-fingerprints/MoleculeACE_chembl4616_ec50

Viewer • Updated Oct 15, 2025 • 682 • 47

scikit-fingerprints/MoleculeACE_chembl4203_ki

Viewer • Updated Oct 15, 2025 • 731 • 86

scikit-fingerprints/MoleculeACE_chembl4005_ki

Viewer • Updated Oct 15, 2025 • 960 • 45

scikit-fingerprints/MoleculeACE_chembl3979_ec50

Viewer • Updated Oct 15, 2025 • 1.13k • 44

scikit-fingerprints/MoleculeACE_chembl2971_ki

Viewer • Updated Oct 15, 2025 • 976 • 43
View 82 datasets
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