Datasets:
Languages:
English
Size:
10M - 100M
ArXiv:
Tags:
chemistry
scientific-language-interfaced-data
multimodality-data
molecular-imaging
tabular-data
chemistry-mlift
License:
Add hiv-multimodal config via script
Browse files- README.md +44 -0
- hiv-multimodal/test-00000-of-00004.parquet +3 -0
- hiv-multimodal/test-00001-of-00004.parquet +3 -0
- hiv-multimodal/test-00002-of-00004.parquet +3 -0
- hiv-multimodal/test-00003-of-00004.parquet +3 -0
- hiv-multimodal/train-00000-of-00015.parquet +3 -0
- hiv-multimodal/train-00001-of-00015.parquet +3 -0
- hiv-multimodal/train-00002-of-00015.parquet +3 -0
- hiv-multimodal/train-00003-of-00015.parquet +3 -0
- hiv-multimodal/train-00004-of-00015.parquet +3 -0
- hiv-multimodal/train-00005-of-00015.parquet +3 -0
- hiv-multimodal/train-00006-of-00015.parquet +3 -0
- hiv-multimodal/train-00007-of-00015.parquet +3 -0
- hiv-multimodal/train-00008-of-00015.parquet +3 -0
- hiv-multimodal/train-00009-of-00015.parquet +3 -0
- hiv-multimodal/train-00010-of-00015.parquet +3 -0
- hiv-multimodal/train-00011-of-00015.parquet +3 -0
- hiv-multimodal/train-00012-of-00015.parquet +3 -0
- hiv-multimodal/train-00013-of-00015.parquet +3 -0
- hiv-multimodal/train-00014-of-00015.parquet +3 -0
- hiv-multimodal/validation-00000-of-00003.parquet +3 -0
- hiv-multimodal/validation-00001-of-00003.parquet +3 -0
- hiv-multimodal/validation-00002-of-00003.parquet +3 -0
README.md
CHANGED
@@ -34,6 +34,42 @@ dataset_info:
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num_examples: 11145
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download_size: 186042451
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dataset_size: 928065467.75
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- config_name: nr_aromatase_tox21-multimodal
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features:
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- name: IMAGE
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@@ -79,6 +115,14 @@ configs:
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path: MUV_644-multimodal/validation-*
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- split: test
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path: MUV_644-multimodal/test-*
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- config_name: nr_aromatase_tox21-multimodal
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data_files:
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- split: train
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num_examples: 11145
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download_size: 186042451
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dataset_size: 928065467.75
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+
- config_name: hiv-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: activity_HIV
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dtype: int64
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splits:
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- name: train
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num_bytes: 7150719268.31
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num_examples: 515413
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- name: test
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num_bytes: 1744638529.57
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num_examples: 130511
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- name: validation
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num_bytes: 1470475294.46
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num_examples: 104158
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+
download_size: 689797030
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+
dataset_size: 10365833092.34
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- config_name: nr_aromatase_tox21-multimodal
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features:
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- name: IMAGE
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path: MUV_644-multimodal/validation-*
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- split: test
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path: MUV_644-multimodal/test-*
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+
- config_name: hiv-multimodal
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data_files:
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+
- split: train
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path: hiv-multimodal/train-*
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+
- split: test
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path: hiv-multimodal/test-*
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+
- split: validation
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path: hiv-multimodal/validation-*
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- config_name: nr_aromatase_tox21-multimodal
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data_files:
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- split: train
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hiv-multimodal/test-00000-of-00004.parquet
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