Datasets:

ailab-bio
/

TACK

	---
	dataset_info:
	- config_name: DC50
	features:
	- name: SMILES
	dtype: string
	- name: POI_Name
	dtype: string
	- name: POI_Sequence
	dtype: string
	- name: Ligase_Name
	dtype: string
	- name: Cell_Line
	dtype: string
	- name: Value_Type
	dtype: string
	- name: Value_Unit
	dtype: string
	- name: Value
	dtype: float64
	- name: Value_Error
	dtype: float64
	- name: Value_Range_Min
	dtype: float64
	- name: Value_Range_Max
	dtype: float64
	- name: Value_Concentration
	dtype: float64
	- name: Assay_Time
	dtype: float64
	- name: Value_Operator
	dtype: string
	- name: Value_Category
	dtype: string
	- name: Value_Concentration_Unit
	dtype: string
	- name: Modality
	dtype: string
	- name: POI_UniProt
	dtype: string
	- name: Ligase_UniProt
	dtype: string
	- name: Ligase_Sequence
	dtype: string
	- name: Cell_Line_ID
	dtype: string
	- name: Cell_Line_Species
	dtype: string
	- name: Reference
	dtype: string
	- name: Description
	dtype: string
	- name: Database
	dtype: string
	- name: Assay
	dtype: string
	- name: TPD_ID
	dtype: string
	- name: POI_Cluster
	dtype: int64
	- name: SMILES_Held_Out
	dtype: bool
	- name: SMILES_Scaffold_Cluster
	dtype: int64
	- name: SMILES_Butina_Cluster
	dtype: int64
	splits:
	- name: train
	num_bytes: 14046158
	num_examples: 4184
	download_size: 574242
	dataset_size: 14046158
	- config_name: Dmax
	features:
	- name: SMILES
	dtype: string
	- name: POI_Name
	dtype: string
	- name: POI_Sequence
	dtype: string
	- name: Ligase_Name
	dtype: string
	- name: Cell_Line
	dtype: string
	- name: Value_Type
	dtype: string
	- name: Value_Unit
	dtype: string
	- name: Value
	dtype: float64
	- name: Value_Error
	dtype: float64
	- name: Value_Range_Min
	dtype: float64
	- name: Value_Range_Max
	dtype: float64
	- name: Value_Concentration
	dtype: float64
	- name: Assay_Time
	dtype: float64
	- name: Value_Operator
	dtype: string
	- name: Value_Category
	dtype: string
	- name: Value_Concentration_Unit
	dtype: string
	- name: Modality
	dtype: string
	- name: POI_UniProt
	dtype: string
	- name: Ligase_UniProt
	dtype: string
	- name: Ligase_Sequence
	dtype: string
	- name: Cell_Line_ID
	dtype: string
	- name: Cell_Line_Species
	dtype: string
	- name: Reference
	dtype: string
	- name: Description
	dtype: string
	- name: Database
	dtype: string
	- name: Assay
	dtype: string
	- name: TPD_ID
	dtype: string
	- name: POI_Cluster
	dtype: int64
	- name: SMILES_Held_Out
	dtype: bool
	- name: SMILES_Scaffold_Cluster
	dtype: int64
	- name: SMILES_Butina_Cluster
	dtype: int64
	splits:
	- name: train
	num_bytes: 7751718
	num_examples: 2377
	download_size: 316126
	dataset_size: 7751718
	- config_name: default
	features:
	- name: SMILES
	dtype: string
	- name: POI_Name
	dtype: string
	- name: POI_Sequence
	dtype: string
	- name: Ligase_Name
	dtype: string
	- name: Cell_Line
	dtype: string
	- name: Value_Type
	dtype: string
	- name: Value_Unit
	dtype: string
	- name: Value
	dtype: float64
	- name: Value_Error
	dtype: float64
	- name: Value_Range_Min
	dtype: float64
	- name: Value_Range_Max
	dtype: float64
	- name: Value_Concentration
	dtype: float64
	- name: Assay_Time
	dtype: float64
	- name: Value_Operator
	dtype: string
	- name: Value_Category
	dtype: string
	- name: Value_Concentration_Unit
	dtype: string
	- name: Modality
	dtype: string
	- name: POI_UniProt
	dtype: string
	- name: Ligase_UniProt
	dtype: string
	- name: Ligase_Sequence
	dtype: string
	- name: Cell_Line_ID
	dtype: string
	- name: Cell_Line_Species
	dtype: string
	- name: Reference
	dtype: string
	- name: Description
	dtype: string
	- name: Database
	dtype: string
	- name: Assay
	dtype: string
	- name: TPD_ID
	dtype: string
	- name: POI_Cluster
	dtype: int64
	- name: SMILES_Held_Out
	dtype: bool
	- name: SMILES_Scaffold_Cluster
	dtype: int64
	- name: SMILES_Butina_Cluster
	dtype: int64
	splits:
	- name: train
	num_bytes: 21797876
	num_examples: 6561
	download_size: 744106
	dataset_size: 21797876
	- config_name: multitask
	features:
	- name: SMILES
	dtype: string
	- name: POI_Name
	dtype: string
	- name: POI_Sequence
	dtype: string
	- name: Ligase_Name
	dtype: string
	- name: Cell_Line
	dtype: string
	- name: Value_Type_DC50
	dtype: string
	- name: Value_Unit_DC50
	dtype: string
	- name: Value_DC50
	dtype: float64
	- name: Value_Error_DC50
	dtype: float64
	- name: Value_Range_Min_DC50
	dtype: float64
	- name: Value_Range_Max_DC50
	dtype: float64
	- name: Value_Concentration_DC50
	dtype: float64
	- name: Assay_Time
	dtype: float64
	- name: Value_Operator_DC50
	dtype: string
	- name: Value_Category_DC50
	dtype: string
	- name: Value_Concentration_Unit_DC50
	dtype: 'null'
	- name: Modality
	dtype: string
	- name: POI_UniProt
	dtype: string
	- name: Ligase_UniProt
	dtype: string
	- name: Ligase_Sequence
	dtype: string
	- name: Cell_Line_ID
	dtype: string
	- name: Cell_Line_Species
	dtype: string
	- name: Reference
	dtype: string
	- name: Description
	dtype: string
	- name: Database
	dtype: string
	- name: Assay
	dtype: string
	- name: TPD_ID_DC50
	dtype: string
	- name: POI_Cluster
	dtype: int64
	- name: SMILES_Held_Out
	dtype: bool
	- name: SMILES_Scaffold_Cluster
	dtype: int64
	- name: SMILES_Butina_Cluster
	dtype: int64
	- name: Value_Type_Dmax
	dtype: string
	- name: Value_Unit_Dmax
	dtype: string
	- name: Value_Dmax
	dtype: float64
	- name: Value_Error_Dmax
	dtype: float64
	- name: Value_Range_Min_Dmax
	dtype: float64
	- name: Value_Range_Max_Dmax
	dtype: float64
	- name: Value_Concentration_Dmax
	dtype: float64
	- name: Value_Operator_Dmax
	dtype: string
	- name: Value_Category_Dmax
	dtype: string
	- name: Value_Concentration_Unit_Dmax
	dtype: string
	- name: TPD_ID_Dmax
	dtype: string
	splits:
	- name: train
	num_bytes: 5766659
	num_examples: 1563
	download_size: 244944
	dataset_size: 5766659
	configs:
	- config_name: DC50
	data_files:
	- split: train
	path: DC50/train-*
	- config_name: Dmax
	data_files:
	- split: train
	path: Dmax/train-*
	- config_name: default
	data_files:
	- split: train
	path: data/train-*
	- config_name: multitask
	data_files:
	- split: train
	path: multitask/train-*
	---