maykcaldas
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README.md
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pretty_name: smiles-transformer-dataset
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size_categories:
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- 100M<n<1B
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-
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pretty_name: smiles-transformer-dataset
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size_categories:
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- 100M<n<1B
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dataset_info:
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features:
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- name: text
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dtype: string
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- name: formula
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dtype: string
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- name: NumHDonors
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dtype: int64
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- name: NumHAcceptors
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dtype: int64
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- name: MolLogP
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dtype: float64
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- name: NumHeteroatoms
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dtype: int64
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- name: RingCount
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dtype: int64
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- name: NumRotatableBonds
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dtype: int64
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- name: NumAromaticBonds
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dtype: int64
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- name: NumAcidGroups
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dtype: int64
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- name: NumBasicGroups
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dtype: int64
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- name: Apol
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dtype: float64
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splits:
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- name: train
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num_bytes: 6764409
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num_examples: 40999
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- name: test
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num_bytes: 881559
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num_examples: 5128
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- name: validation
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num_bytes: 825326
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num_examples: 5128
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download_size: 2440791
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dataset_size: 8471294
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---
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