jiahborcn commited on
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Upload dataset

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README.md CHANGED
@@ -3,21 +3,27 @@ dataset_info:
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  features:
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  - name: smiles
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  dtype: string
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- - name: chembl_id
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- dtype: string
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  - name: labels
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  sequence: int64
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  - name: mask
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  sequence: int64
 
 
 
 
 
 
 
 
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  splits:
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  - name: train
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- num_bytes: 1600466357.1257262
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  num_examples: 350183
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  - name: test
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- num_bytes: 400117731.87427384
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  num_examples: 87546
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- download_size: 24331560
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- dataset_size: 2000584089.0
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  configs:
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  - config_name: default
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  data_files:
 
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  features:
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  - name: smiles
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  dtype: string
 
 
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  - name: labels
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  sequence: int64
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  - name: mask
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  sequence: int64
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+ - name: MW
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+ dtype: float64
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+ - name: LogP
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+ dtype: float64
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+ - name: TPSA
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+ dtype: float64
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+ - name: Complexity
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+ dtype: float64
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  splits:
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  - name: train
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+ num_bytes: 1605736737.3156543
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  num_examples: 350183
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  - name: test
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+ num_bytes: 401435330.6843458
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  num_examples: 87546
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+ download_size: 31528613
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+ dataset_size: 2007172068.0
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  configs:
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  - config_name: default
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  data_files:
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