ChrisTho commited on
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Upload dataset

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README.md ADDED
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+ ---
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+ dataset_info:
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+ features:
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+ - name: precursor_mz
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+ dtype: float32
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+ - name: precursor_charge
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+ dtype: int32
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+ - name: mzs
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+ sequence: float32
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+ - name: intensities
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+ sequence: float32
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+ - name: collision_energy
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+ dtype: string
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+ - name: instrument_type
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+ dtype: string
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+ - name: in_silico
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+ dtype: bool
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+ - name: smiles
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+ dtype: string
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+ - name: adduct
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+ dtype: string
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+ - name: compound_class
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+ dtype: string
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+ splits:
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+ - name: train
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+ num_bytes: 821110728
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+ num_examples: 747796
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+ - name: test
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+ num_bytes: 228202761
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+ num_examples: 207722
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+ - name: validation
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+ num_bytes: 91290188
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+ num_examples: 83089
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+ download_size: 1248961556
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+ dataset_size: 1140603677
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+ configs:
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+ - config_name: default
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+ data_files:
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+ - split: train
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+ path: data/train-*
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+ - split: test
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+ path: data/test-*
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+ - split: validation
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+ path: data/validation-*
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+ ---
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