uspto_1k_TPL / README.md
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metadata
dataset_info:
  features:
    - name: 'Unnamed: 0'
      dtype: int64
    - name: level_0
      dtype: int64
    - name: index
      dtype: float64
    - name: original_rxn
      dtype: string
    - name: fragments
      dtype: string
    - name: source
      dtype: string
    - name: year
      dtype: int64
    - name: mapped_rxn
      dtype: string
    - name: confidence
      dtype: float64
    - name: canonical_rxn_with_fragment_info
      dtype: string
    - name: canonical_rxn
      dtype: string
    - name: ID
      dtype: string
    - name: reaction_hash
      dtype: string
    - name: reactants
      dtype: string
    - name: products
      dtype: string
    - name: retro_template
      dtype: string
    - name: template_hash
      dtype: string
    - name: selectivity
      dtype: float64
    - name: outcomes
      dtype: float64
    - name: reagents
      dtype: string
    - name: labels
      dtype: int64
  splits:
    - name: train
      num_bytes: 754334119
      num_examples: 400604
    - name: test
      num_bytes: 83993127
      num_examples: 44511
  download_size: 363489916
  dataset_size: 838327246
configs:
  - config_name: default
    data_files:
      - split: train
        path: data/train-*
      - split: test
        path: data/test-*