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 3 months ago

scikit-fingerprints/LRGB_Peptides-struct

morgul10 updated a dataset 3 months ago

scikit-fingerprints/LRGB_Peptides-func

morgul10 updated a dataset 6 months ago

scikit-fingerprints/MoleculeNet_PCBA

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models

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datasets 14

scikit-fingerprints/LRGB_Peptides-struct

Viewer • Updated Oct 11, 2024 • 15.5k • 158

scikit-fingerprints/LRGB_Peptides-func

Viewer • Updated Oct 11, 2024 • 15.5k • 156

scikit-fingerprints/MoleculeNet_PCBA

Viewer • Updated Jul 18, 2024 • 438k • 163

scikit-fingerprints/MoleculeNet_ToxCast

Viewer • Updated Jul 18, 2024 • 8.58k • 164

scikit-fingerprints/MoleculeNet_Tox21

Viewer • Updated Jul 18, 2024 • 7.83k • 178

scikit-fingerprints/MoleculeNet_SIDER

Viewer • Updated Jul 18, 2024 • 1.43k • 166

scikit-fingerprints/MoleculeNet_MUV

Viewer • Updated Jul 18, 2024 • 93.1k • 163

scikit-fingerprints/MoleculeNet_ClinTox

Viewer • Updated Jul 18, 2024 • 1.48k • 162

scikit-fingerprints/MoleculeNet_HIV

Viewer • Updated Jul 18, 2024 • 41.1k • 158

scikit-fingerprints/MoleculeNet_BBBP

Viewer • Updated Jul 18, 2024 • 2.04k • 160