AdrianM0 commited on
Commit
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1 Parent(s): 668ff29

Add hiv-multimodal config via script

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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
@@ -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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