AdrianM0 commited on
Commit
57d50a3
·
verified ·
1 Parent(s): ed592d0

Add clintox-multimodal config via script

Browse files
README.md CHANGED
@@ -310,6 +310,42 @@ dataset_info:
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  num_examples: 330
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  download_size: 511908414
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  dataset_size: 4601889843.3
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
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  - config_name: cyp3a4_substrate_carbonmangels-multimodal
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  features:
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  - name: IMAGE
@@ -559,6 +595,14 @@ configs:
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  path: chebi_20-multimodal/validation-*
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  - split: test
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  path: chebi_20-multimodal/test-*
 
 
 
 
 
 
 
 
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  - config_name: cyp3a4_substrate_carbonmangels-multimodal
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  data_files:
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  - split: validation
 
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  num_examples: 330
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  download_size: 511908414
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  dataset_size: 4601889843.3
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+ - config_name: clintox-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: clinical_toxicity
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+ dtype: int64
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+ splits:
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+ - name: train
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+ num_bytes: 234537091.9
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+ num_examples: 17670
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+ - name: test
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+ num_bytes: 67453862.81
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+ num_examples: 5263
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+ - name: validation
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+ num_bytes: 49762678.58
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+ num_examples: 3534
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+ download_size: 23562688
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+ dataset_size: 351753633.29
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  - config_name: cyp3a4_substrate_carbonmangels-multimodal
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  features:
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  - name: IMAGE
 
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  path: chebi_20-multimodal/validation-*
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  - split: test
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  path: chebi_20-multimodal/test-*
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+ - config_name: clintox-multimodal
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+ data_files:
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+ - split: train
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+ path: clintox-multimodal/train-*
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+ - split: test
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+ path: clintox-multimodal/test-*
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+ - split: validation
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+ path: clintox-multimodal/validation-*
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  - config_name: cyp3a4_substrate_carbonmangels-multimodal
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  data_files:
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  - split: validation
clintox-multimodal/test-00000-of-00001.parquet ADDED
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clintox-multimodal/train-00000-of-00001.parquet ADDED
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clintox-multimodal/validation-00000-of-00001.parquet ADDED
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