jiosephlee/context-conditioned-molecule-transfer-v7.3-skin-reaction-vote-mean-intern

Skin_Reaction context-conditioned molecule transfer v7_3 This release is independent of the molecule-only V1.x family. Its node is a parent molecule under one exact selected external-condition signature. train rows: 92,016 validation_ranking rows: 6,073 test_ranking rows: 18,697 Validation: Morgan top-75 parents, then every context row Test: Morgan top-75 parents, then every context row SD target: train_sd_sigmoid_center_1.0_temperature_0.25_unclipped.v7.3 Original TxAgent test… See the full description on the dataset page: https://huggingface.co/datasets/jiosephlee/context-conditioned-molecule-transfer-v7.3-skin-reaction-vote-mean-intern.