Datasets:
Languages:
English
Size:
10M - 100M
ArXiv:
Tags:
chemistry
scientific-language-interfaced-data
multimodality-data
molecular-imaging
tabular-data
chemistry-mlift
License:
Add sr_p53_tox21-multimodal config via script
Browse files
README.md
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@@ -212,6 +212,42 @@ 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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configs:
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- config_name: MUV_644-multimodal
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data_files:
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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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---
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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_p53_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-p53
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dtype: int64
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splits:
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- name: train
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num_bytes: 847107765.27
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num_examples: 77121
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- name: test
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num_bytes: 407373354.09
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num_examples: 35207
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- name: validation
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num_bytes: 143952678.46
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num_examples: 11058
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download_size: 95003680
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dataset_size: 1398433797.82
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configs:
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- config_name: MUV_644-multimodal
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data_files:
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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_p53_tox21-multimodal
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data_files:
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- split: train
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path: sr_p53_tox21-multimodal/train-*
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+
- split: test
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+
path: sr_p53_tox21-multimodal/test-*
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+
- split: validation
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path: sr_p53_tox21-multimodal/validation-*
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---
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sr_p53_tox21-multimodal/test-00000-of-00001.parquet
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version https://git-lfs.github.com/spec/v1
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oid sha256:53f2921ec2342316700a7ab381ddf03713f080907d0592b552361fa3a277d6bf
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size 27140192
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sr_p53_tox21-multimodal/train-00000-of-00002.parquet
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version https://git-lfs.github.com/spec/v1
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+
oid sha256:65e90ad6617d4a55a1cf31690aeee4002ff491cda59e96c31d7113d8ebcc057d
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+
size 28887156
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sr_p53_tox21-multimodal/train-00001-of-00002.parquet
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version https://git-lfs.github.com/spec/v1
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+
oid sha256:01122c271d58b28995c3cfadb618f1dbff475af3850b4aa66585338e44b9cc99
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size 29483170
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sr_p53_tox21-multimodal/validation-00000-of-00001.parquet
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version https://git-lfs.github.com/spec/v1
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| 2 |
+
oid sha256:3eae1c30e8b9ffbb5a5887f2098ca5334dd612d16c3c86b3c3a5609ea789f0ea
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| 3 |
+
size 9493162
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