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giadefa 

updated a model 14 days ago

compsciencelab/AMARO2

Updated 14 days ago

AntonioMirarchi 

updated a model 14 days ago

compsciencelab/AMARO2

Updated 14 days ago

AntonioMirarchi 

published a model 15 days ago

compsciencelab/AMARO2

Updated 14 days ago

AntonioMirarchi 

published a model 4 months ago

compsciencelab/AMARO

Updated Jul 2

AntonioMirarchi 

updated a model 4 months ago

compsciencelab/AMARO

Updated Jul 2

juanlrdc 

updated a dataset 8 months ago

compsciencelab/traces_claude_chem_agent

Viewer • Updated Mar 24 • 496 • 49

juanlrdc 

published a dataset 8 months ago

compsciencelab/traces_claude_chem_agent

Viewer • Updated Mar 24 • 496 • 49

juanlrdc 

updated 2 datasets 9 months ago

compsciencelab/full_tdc_datasets

Viewer • Updated Feb 24 • 5.67M • 39

compsciencelab/tdc_benchmark

Viewer • Updated Feb 19 • 6.08k • 44

juanlrdc 

published 2 datasets 9 months ago

compsciencelab/tdc_benchmark

Viewer • Updated Feb 19 • 6.08k • 44

compsciencelab/full_tdc_datasets

Viewer • Updated Feb 24 • 5.67M • 39

juanlrdc 

updated a dataset 9 months ago

compsciencelab/tdc_txgemma_dataset

Viewer • Updated Feb 12 • 111k • 32 • 1

giadefa 

submitted a paper to Daily Papers 10 months ago

AceFF: A State-of-the-Art Machine Learning Potential for Small Molecules

Paper • 2601.00581 • Published Jan 2 • 2

juanlrdc 

updated a dataset about 1 year ago

compsciencelab/ames_mutagenecity_mordred

Viewer • Updated Sep 19, 2025 • 1.2k • 30

juanlrdc 

published a dataset about 1 year ago

compsciencelab/ames_mutagenecity_mordred

Viewer • Updated Sep 19, 2025 • 1.2k • 30

juanlrdc 

published a dataset over 1 year ago

compsciencelab/tdc_txgemma_dataset

Viewer • Updated Feb 12 • 111k • 32 • 1

AntonioMirarchi 

updated a dataset almost 2 years ago

compsciencelab/mdCATH

Updated Nov 30, 2024 • 45.9k • 17

giadefa 

updated a dataset about 2 years ago

compsciencelab/mdCATH

Updated Nov 30, 2024 • 45.9k • 17

Sebasdi 

updated a dataset about 2 years ago

compsciencelab/BricksRL-Datasets

Preview • Updated Sep 30, 2024 • 200