Upload dataset
Browse files
README.md
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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:
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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_bytes:
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num_examples: 11420
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- name: valid
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num_bytes:
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num_examples: 2530
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- name: test
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num_bytes:
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num_examples: 1180
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download_size:
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dataset_size:
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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: split
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dtype: string
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- name: IMAGE
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dtype: binary
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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_bytes: 160044862
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num_examples: 11420
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- name: valid
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num_bytes: 33287634
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num_examples: 2530
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- name: test
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num_bytes: 17204831
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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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chempile-xtra/test-00000-of-00001.parquet
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version https://git-lfs.github.com/spec/v1
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oid sha256:
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size
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version https://git-lfs.github.com/spec/v1
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oid sha256:91c93f119c1561121e84c5bc22a592d8a335085d57e725bd434576b0b3ccf9f0
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size 16600397
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chempile-xtra/train-00000-of-00001.parquet
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size
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size 153998992
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chempile-xtra/valid-00000-of-00001.parquet
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size 31980997
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