AdrianM0 commited on
Commit
7358572
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1 Parent(s): cf18bdc

Add ld50_zhu-multimodal config via script

Browse files
README.md CHANGED
@@ -1404,6 +1404,42 @@ dataset_info:
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  num_examples: 357
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  download_size: 110718808
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  dataset_size: 732396836.15
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
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  - config_name: m1_muscarinic_receptor_agonists_butkiewicz-multimodal
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  features:
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  - name: IMAGE
@@ -2665,6 +2701,14 @@ configs:
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  path: ld50_catmos-multimodal/test-*
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  - split: validation
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  path: ld50_catmos-multimodal/validation-*
 
 
 
 
 
 
 
 
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  - config_name: m1_muscarinic_receptor_agonists_butkiewicz-multimodal
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  data_files:
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  - split: train
 
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  num_examples: 357
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  download_size: 110718808
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  dataset_size: 732396836.15
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+ - config_name: ld50_zhu-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_name
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+ dtype: string
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+ - name: acute_toxicity
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+ dtype: float64
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+ splits:
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+ - name: train
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+ num_bytes: 1314009213.77
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+ num_examples: 87571
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+ - name: test
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+ num_bytes: 647526101.93
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+ num_examples: 41439
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+ - name: validation
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+ num_bytes: 179950770.98
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+ num_examples: 10754
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+ download_size: 142543278
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+ dataset_size: 2141486086.6799998
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  - config_name: m1_muscarinic_receptor_agonists_butkiewicz-multimodal
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  features:
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  - name: IMAGE
 
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  path: ld50_catmos-multimodal/test-*
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  - split: validation
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  path: ld50_catmos-multimodal/validation-*
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+ - config_name: ld50_zhu-multimodal
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+ data_files:
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+ - split: train
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+ path: ld50_zhu-multimodal/train-*
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+ - split: test
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+ path: ld50_zhu-multimodal/test-*
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+ - split: validation
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+ path: ld50_zhu-multimodal/validation-*
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  - config_name: m1_muscarinic_receptor_agonists_butkiewicz-multimodal
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  data_files:
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  - split: train
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