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Add uniprot_binding_sites_multiple-multimodal config via script

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  1. README.md +46 -0
  2. uniprot_binding_sites_multiple-multimodal/test-00000-of-00007.parquet +3 -0
  3. uniprot_binding_sites_multiple-multimodal/test-00001-of-00007.parquet +3 -0
  4. uniprot_binding_sites_multiple-multimodal/test-00002-of-00007.parquet +3 -0
  5. uniprot_binding_sites_multiple-multimodal/test-00003-of-00007.parquet +3 -0
  6. uniprot_binding_sites_multiple-multimodal/test-00004-of-00007.parquet +3 -0
  7. uniprot_binding_sites_multiple-multimodal/test-00005-of-00007.parquet +3 -0
  8. uniprot_binding_sites_multiple-multimodal/test-00006-of-00007.parquet +3 -0
  9. uniprot_binding_sites_multiple-multimodal/train-00000-of-00030.parquet +3 -0
  10. uniprot_binding_sites_multiple-multimodal/train-00001-of-00030.parquet +3 -0
  11. uniprot_binding_sites_multiple-multimodal/train-00002-of-00030.parquet +3 -0
  12. uniprot_binding_sites_multiple-multimodal/train-00003-of-00030.parquet +3 -0
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  21. uniprot_binding_sites_multiple-multimodal/train-00012-of-00030.parquet +3 -0
  22. uniprot_binding_sites_multiple-multimodal/train-00013-of-00030.parquet +3 -0
  23. uniprot_binding_sites_multiple-multimodal/train-00014-of-00030.parquet +3 -0
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  25. uniprot_binding_sites_multiple-multimodal/train-00016-of-00030.parquet +3 -0
  26. uniprot_binding_sites_multiple-multimodal/train-00017-of-00030.parquet +3 -0
  27. uniprot_binding_sites_multiple-multimodal/train-00018-of-00030.parquet +3 -0
  28. uniprot_binding_sites_multiple-multimodal/train-00019-of-00030.parquet +3 -0
  29. uniprot_binding_sites_multiple-multimodal/train-00020-of-00030.parquet +3 -0
  30. uniprot_binding_sites_multiple-multimodal/train-00021-of-00030.parquet +3 -0
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  33. uniprot_binding_sites_multiple-multimodal/train-00024-of-00030.parquet +3 -0
  34. uniprot_binding_sites_multiple-multimodal/train-00025-of-00030.parquet +3 -0
  35. uniprot_binding_sites_multiple-multimodal/train-00026-of-00030.parquet +3 -0
  36. uniprot_binding_sites_multiple-multimodal/train-00027-of-00030.parquet +3 -0
  37. uniprot_binding_sites_multiple-multimodal/train-00028-of-00030.parquet +3 -0
  38. uniprot_binding_sites_multiple-multimodal/train-00029-of-00030.parquet +3 -0
  39. uniprot_binding_sites_multiple-multimodal/validation-00000-of-00001.parquet +3 -0
README.md CHANGED
@@ -904,6 +904,44 @@ dataset_info:
904
  num_examples: 6140
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  download_size: 23617234
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  dataset_size: 120049282.39999999
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
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  configs:
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  - config_name: BBBP-multimodal
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  data_files:
@@ -1093,4 +1131,12 @@ configs:
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  path: thermosol-multimodal/test-*
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  - split: train
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  path: thermosol-multimodal/train-*
 
 
 
 
 
 
 
 
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  ---
 
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  num_examples: 6140
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  download_size: 23617234
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  dataset_size: 120049282.39999999
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+ - config_name: uniprot_binding_sites_multiple-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: sequence
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+ dtype: string
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+ - name: start_binding_site
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+ dtype: int64
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+ - name: end_binding_site
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+ dtype: int64
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+ splits:
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+ - name: train
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+ num_bytes: 14978841938.82
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+ num_examples: 771186
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+ - name: test
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+ num_bytes: 3190333642.84
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+ num_examples: 220332
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+ - name: validation
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+ num_bytes: 209416866.86
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+ num_examples: 10578
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+ download_size: 1049233833
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+ dataset_size: 18378592448.52
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  configs:
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  - config_name: BBBP-multimodal
947
  data_files:
 
1131
  path: thermosol-multimodal/test-*
1132
  - split: train
1133
  path: thermosol-multimodal/train-*
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+ - config_name: uniprot_binding_sites_multiple-multimodal
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+ data_files:
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+ - split: train
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+ path: uniprot_binding_sites_multiple-multimodal/train-*
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+ - split: test
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+ path: uniprot_binding_sites_multiple-multimodal/test-*
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+ - split: validation
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+ path: uniprot_binding_sites_multiple-multimodal/validation-*
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  ---
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