Datasets:
Languages:
English
Size:
10M - 100M
ArXiv:
Tags:
chemistry
scientific-language-interfaced-data
multimodality-data
molecular-imaging
tabular-data
chemistry-mlift
License:
Add sr_atad5_tox21-multimodal config via script
Browse files
README.md
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@@ -488,6 +488,42 @@ dataset_info:
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num_examples: 11025
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download_size: 84869920
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dataset_size: 1325392280.44
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- config_name: sr_mmp_tox21-multimodal
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features:
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- name: IMAGE
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path: nr_aromatase_tox21-multimodal/test-*
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- split: validation
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path: nr_aromatase_tox21-multimodal/validation-*
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- config_name: sr_mmp_tox21-multimodal
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data_files:
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- split: train
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num_examples: 11025
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download_size: 84869920
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dataset_size: 1325392280.44
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+
- config_name: sr_atad5_tox21-multimodal
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features:
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- name: IMAGE
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dtype: image
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- name: template
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dtype: string
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- name: template_original
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dtype: string
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- name: SMILES
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dtype: string
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- name: SMILES_ORIGINAL
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dtype: string
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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: compound_id
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dtype: string
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- name: toxicity_SR-ATAD5
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dtype: int64
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splits:
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- name: train
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num_bytes: 992391334.75
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num_examples: 88725
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- name: test
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num_bytes: 463974923.78
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num_examples: 40194
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- name: validation
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num_bytes: 173904208.07
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num_examples: 13461
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download_size: 104215405
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dataset_size: 1630270466.6
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- config_name: sr_mmp_tox21-multimodal
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features:
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- name: IMAGE
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path: nr_aromatase_tox21-multimodal/test-*
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- split: validation
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path: nr_aromatase_tox21-multimodal/validation-*
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+
- config_name: sr_atad5_tox21-multimodal
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data_files:
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- split: train
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path: sr_atad5_tox21-multimodal/train-*
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+
- split: test
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path: sr_atad5_tox21-multimodal/test-*
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- split: validation
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+
path: sr_atad5_tox21-multimodal/validation-*
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- config_name: sr_mmp_tox21-multimodal
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data_files:
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- split: train
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sr_atad5_tox21-multimodal/test-00000-of-00001.parquet
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version https://git-lfs.github.com/spec/v1
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oid sha256:53689139e903ea975e05ecd40e42c7b3ba2645d4628c57f65bbe7b05f6b30d4d
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+
size 29043660
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sr_atad5_tox21-multimodal/train-00000-of-00002.parquet
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version https://git-lfs.github.com/spec/v1
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oid sha256:f04006801fe7b5f3b07addd065e126331ac2da2afea089b7fd54fdcce370d660
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size 31618444
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sr_atad5_tox21-multimodal/train-00001-of-00002.parquet
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version https://git-lfs.github.com/spec/v1
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oid sha256:32b5448cb54fc7b05d906de777dc78c9733f83a63b49cdb92ff152a121c47292
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size 32602453
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sr_atad5_tox21-multimodal/validation-00000-of-00001.parquet
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version https://git-lfs.github.com/spec/v1
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+
oid sha256:d813a107a1beb6fc616462252b29ea005a112ea93b0354475c54df6df263d13d
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| 3 |
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size 10950848
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