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molecular-property-prediction

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Active filters: molecular-property-prediction

Reverb/atlas-1-molecular-property-prediction

Graph Machine Learning • Updated Dec 25, 2025 • 12

yerevann/chemlactica-125m

Text Generation • 0.1B • Updated Sep 3 • 205 • 1

yerevann/chemma-2b

Text Generation • 3B • Updated Sep 3 • 1.02k • 5

ibm-research/biomed.sm.mv-te-84m

84.1M • Updated Feb 24 • 249 • 19

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-BACE-101

84.6M • Updated Feb 24 • 71 • 3

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-MUV-101

84.6M • Updated Nov 1, 2024 • 26 • 2

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-SIDER-101

84.6M • Updated Nov 1, 2024 • 38 • 2

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-TOX21-101

84.6M • Updated Nov 1, 2024 • 33 • 1

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-LIPOPHILICITY-101

84.6M • Updated Nov 1, 2024 • 59 • 1

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-TOXCAST-101

84.8M • Updated Nov 1, 2024 • 23 • 1

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-CLINTOX-101

84.6M • Updated Nov 1, 2024 • 22 • 1

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-ESOL-101

84.6M • Updated Nov 1, 2024 • 28 • 1

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-BBBP-101

84.6M • Updated Nov 1, 2024 • 36 • 1

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-QM7-101

84.6M • Updated Nov 1, 2024 • 30 • 1

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-FREESOLV-101

84.6M • Updated Nov 1, 2024 • 30 • 1

ibm-research/biomed.sm.mv-te-84m-MoleculeNet-ligand_scaffold-HIV-101

84.6M • Updated Nov 1, 2024 • 26 • 1

Einae/AttrMask

Updated Apr 6, 2025 • 8

Einae/ContextPred

Updated Apr 8, 2025 • 10

Einae/EdgePred

Updated Apr 11, 2025 • 8

Einae/Moama

Updated Apr 3, 2025 • 8

ibm-research/biomed.sm.mv-te-84m-ComputationalADME-random-HLM-101

84.6M • Updated Jun 3, 2025 • 11

ibm-research/biomed.sm.mv-te-84m-ComputationalADME-random-HPPB-101

84.6M • Updated Jun 3, 2025 • 15

ibm-research/biomed.sm.mv-te-84m-ComputationalADME-random-MDR1-MDCK-ER-101

84.6M • Updated Jun 3, 2025 • 21

ibm-research/biomed.sm.mv-te-84m-ComputationalADME-random-RLM-101

84.6M • Updated Jun 3, 2025 • 7

ibm-research/biomed.sm.mv-te-84m-ComputationalADME-random-RPPB-101

84.6M • Updated Jun 3, 2025 • 10

ibm-research/biomed.sm.mv-te-84m-ComputationalADME-random-SOLUBILITY-101

84.6M • Updated Jun 3, 2025 • 12

alarv/pyrosage-ames-attentivefp

Text Classification • Updated Jun 5, 2025 • 16

upci-ntua/pyrosage-endocrine_disruption_nr-ahr-attentivefp

Text Classification • Updated Jun 5, 2025 • 10

upci-ntua/pyrosage-ames-attentivefp

Text Classification • Updated Jun 5, 2025 • 7

upci-ntua/pyrosage-endocrine_disruption_nr-aromatase-attentivefp

Text Classification • Updated Jun 5, 2025 • 10