jiosephlee/context-conditioned-molecule-transfer-v3.0-bbb-martins-vote-mean-intern
BBB_Martins context-conditioned molecule transfer v3_0 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: 35,808 validation_ranking rows: 4,483 validation_ranking_random_balanced rows: 4,483 test_ranking rows: 30,451 test_ranking_random_balanced rows: 30,451 Validation: Morgan top-75 parents, then every context row Test: Morgan top-75 parents, then every context row… See the full description on the dataset page: https://huggingface.co/datasets/jiosephlee/context-conditioned-molecule-transfer-v3.0-bbb-martins-vote-mean-intern.
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