Datasets:
Languages:
English
Size:
10M - 100M
ArXiv:
Tags:
chemistry
scientific-language-interfaced-data
multimodality-data
molecular-imaging
tabular-data
chemistry-mlift
License:
Add sr_mmp_tox21-multimodal config via script
Browse files
README.md
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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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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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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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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-MMP
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dtype: int64
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splits:
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- name: train
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num_bytes: 718878177.1
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num_examples: 65930
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- name: test
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num_bytes: 343768345.11
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num_examples: 30153
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- name: validation
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num_bytes: 124458379.06
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num_examples: 9538
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download_size: 80973043
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dataset_size: 1187104901.27
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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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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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path: sr_mmp_tox21-multimodal/train-*
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+
- split: test
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+
path: sr_mmp_tox21-multimodal/test-*
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+
- split: validation
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+
path: sr_mmp_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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sr_mmp_tox21-multimodal/test-00000-of-00001.parquet
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version https://git-lfs.github.com/spec/v1
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oid sha256:9bd815466555c5e73358a28704c1242082e0020298cab85f7d6155e707be5cae
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+
size 22936025
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sr_mmp_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:ff38907f8239f462b3ff1c597dbfa90f0b319d5b5998b6198f3357c8595b7392
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size 24693969
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sr_mmp_tox21-multimodal/train-00001-of-00002.parquet
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version https://git-lfs.github.com/spec/v1
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| 3 |
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size 25062503
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sr_mmp_tox21-multimodal/validation-00000-of-00001.parquet
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@@ -0,0 +1,3 @@
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version https://git-lfs.github.com/spec/v1
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| 2 |
+
oid sha256:18eac48c8b73139cd92dec9b14c880cfac0abbd5d3cee649dc12e2007862202c
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size 8280546
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