Collection for the paper "MolEncoder: Towards Optimal Masked Language Modeling for Molecules".
Fabian
fabikru
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AI & ML interests
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Organizations
models 51
fabikru/MolEncoder
Fill-Mask • 15.2M • Updated
• 2.14k
fabikru/molencoder-D3R-simple
Text Classification • 15.2M • Updated
fabikru/model_15M_small_ds_masking_0.7_predicted_hparams
Fill-Mask • 15.2M • Updated
fabikru/model_15M_small_ds_masking_0.8_predicted_hparams
Fill-Mask • 15.2M • Updated
fabikru/model_15M_small_ds_masking_0.9_predicted_hparams
Fill-Mask • 15.2M • Updated
fabikru/model_15M_pubchem_1M_ds_masking_0.3_predicted_hparams
Fill-Mask • 15.2M • Updated
fabikru/model_15M_chembl_1M_ds_masking_0.3_predicted_hparams
Fill-Mask • 15.2M • Updated
fabikru/model_15M_smaller_ds_masking_0.3_predicted_hparams
Fill-Mask • 15.2M • Updated
fabikru/model_15M_smallest_ds_masking_0.3_predicted_hparams
Fill-Mask • 15.2M • Updated
fabikru/model_15M_medium_ds_masking_0.3_explicit_hs_predicted_hparamas
Fill-Mask • 15.2M • Updated
datasets 15
fabikru/pubchem-1M-randomized-smiles-cleaned
Viewer
• Updated
• 1M • 9 • 1
fabikru/chembl-1M-randomized-smiles-cleaned
Viewer
• Updated
• 1M • 15 • 1
fabikru/chembl-2025-randomized-smiles-cleaned-explicit-hs
Viewer
• Updated
• 2.33M • 6
fabikru/eighth-of-chembl-2025-randomized-smiles-cleaned
Viewer
• Updated
• 340k • 5
fabikru/quarter-of-chembl-2025-randomized-smiles-cleaned
Viewer
• Updated
• 631k • 7
fabikru/half-of-chembl-2025-randomized-smiles-cleaned-rdkit-descriptors
Viewer
• Updated
• 1.21M • 9
fabikru/half-of-chembl-2025-randomized-smiles-cleaned-ecfp4
Viewer
• Updated
• 1.21M • 8
fabikru/chembl-2025-randomized-smiles-cleaned-rdkit-descriptors
Viewer
• Updated
• 2.37M • 9 • 1
fabikru/chembl-2025-randomized-smiles-cleaned-ecfp4
Viewer
• Updated
• 2.37M • 8
fabikru/pubchem_and_chembl-2025-randomized-smiles-cleaned
Viewer
• Updated
• 114M • 40