IDEA-AI4S/MolInst_FS_125K_Scaffold_SMILES-MMChat download history

IDEA-AI4S/MolInst_FS_125K_Scaffold_SMILES-MMChat is a dataset on the Hugging Face Hub. In the last 30 days it was downloaded 60 times (18 in the last 7 days), and 920 times in total. It ranks #162,992 among datasets by monthly downloads.

Forward Reaction Prediction Dataset (derived from MolInstruct) molecule representation format: 1D SMILES will further encode into 2D graph features We use scaffold splitting to reconstruct the train-split. We use SMolInstruct FS train split as the sample pool. For Detail, refer to PRESTO: Progre

Open IDEA-AI4S/MolInst_FS_125K_Scaffold_SMILES-MMChat on Hugging Face