AdrianM0 commited on
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1 Parent(s): 0c5e800

Upload dataset

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README.md CHANGED
@@ -2,38 +2,38 @@
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  dataset_info:
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  config_name: chempile-xtra
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  features:
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- - name: template
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- dtype: string
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  - name: SMILES
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  dtype: string
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- - name: IMAGE
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- dtype: image
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  - name: pIC50
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  dtype: float64
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  - name: BACE_inhibition
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  dtype: int64
 
 
 
 
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  - name: SELFIES
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  dtype: string
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  - name: InChI
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  dtype: string
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  - name: IUPAC
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  dtype: string
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- - name: split
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  dtype: string
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  - name: __index_level_0__
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  dtype: int64
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  splits:
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  - name: train
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  num_examples: 11420
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  - name: valid
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  num_examples: 2530
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  - name: test
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- num_bytes: 17243832
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  num_examples: 1180
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- download_size: 202538277
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- dataset_size: 211039842
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  configs:
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  - config_name: chempile-xtra
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  data_files:
 
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  dataset_info:
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  config_name: chempile-xtra
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  features:
 
 
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  - name: SMILES
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  dtype: string
 
 
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  - name: pIC50
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  dtype: float64
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  - name: BACE_inhibition
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  dtype: int64
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  - name: SELFIES
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  dtype: string
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  - name: InChI
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  dtype: string
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  - name: IUPAC
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  dtype: string
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+ - name: template
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  dtype: string
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  - name: __index_level_0__
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  dtype: int64
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  splits:
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  - name: train
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  num_examples: 11420
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  - name: valid
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  num_examples: 2530
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  - name: test
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  num_examples: 1180
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+ download_size: 202580386
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+ dataset_size: 210537327
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  configs:
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  - config_name: chempile-xtra
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  data_files:
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