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Upload dataset

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  1. README.md +49 -0
  2. data/train-00000-of-00036.parquet +3 -0
  3. data/train-00001-of-00036.parquet +3 -0
  4. data/train-00002-of-00036.parquet +3 -0
  5. data/train-00003-of-00036.parquet +3 -0
  6. data/train-00004-of-00036.parquet +3 -0
  7. data/train-00005-of-00036.parquet +3 -0
  8. data/train-00006-of-00036.parquet +3 -0
  9. data/train-00007-of-00036.parquet +3 -0
  10. data/train-00008-of-00036.parquet +3 -0
  11. data/train-00009-of-00036.parquet +3 -0
  12. data/train-00010-of-00036.parquet +3 -0
  13. data/train-00011-of-00036.parquet +3 -0
  14. data/train-00012-of-00036.parquet +3 -0
  15. data/train-00013-of-00036.parquet +3 -0
  16. data/train-00014-of-00036.parquet +3 -0
  17. data/train-00015-of-00036.parquet +3 -0
  18. data/train-00016-of-00036.parquet +3 -0
  19. data/train-00017-of-00036.parquet +3 -0
  20. data/train-00018-of-00036.parquet +3 -0
  21. data/train-00019-of-00036.parquet +3 -0
  22. data/train-00020-of-00036.parquet +3 -0
  23. data/train-00021-of-00036.parquet +3 -0
  24. data/train-00022-of-00036.parquet +3 -0
  25. data/train-00023-of-00036.parquet +3 -0
  26. data/train-00024-of-00036.parquet +3 -0
  27. data/train-00025-of-00036.parquet +3 -0
  28. data/train-00026-of-00036.parquet +3 -0
  29. data/train-00027-of-00036.parquet +3 -0
  30. data/train-00028-of-00036.parquet +3 -0
  31. data/train-00029-of-00036.parquet +3 -0
  32. data/train-00030-of-00036.parquet +3 -0
  33. data/train-00031-of-00036.parquet +3 -0
  34. data/train-00032-of-00036.parquet +3 -0
  35. data/train-00033-of-00036.parquet +3 -0
  36. data/train-00034-of-00036.parquet +3 -0
  37. data/train-00035-of-00036.parquet +3 -0
  38. data/validation-00000-of-00001.parquet +3 -0
README.md CHANGED
@@ -1,3 +1,52 @@
1
  ---
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  license: mit
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
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  ---
 
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  ---
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  license: mit
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+ dataset_info:
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+ features:
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+ - name: edge_index
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+ list:
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+ list: int64
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+ - name: edge_attr
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+ list:
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+ list: int64
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+ - name: x
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+ list:
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+ list: int64
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+ - name: ba_edge_index
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+ list:
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+ list: int64
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+ - name: ba_edge_attr
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+ list:
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+ list: float64
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+ - name: fra_edge_index
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+ list:
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+ list: int64
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+ - name: fra_edge_attr
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+ list:
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+ list: int64
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+ - name: cluster_idx
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+ list: int64
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+ - name: bafra_edge_index
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+ list:
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+ list: int64
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+ - name: bafra_edge_attr
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+ list:
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+ list: float64
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+ - name: smiles
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+ dtype: string
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+ splits:
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+ - name: train
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+ num_bytes: 17772414767
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+ num_examples: 1551232
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+ - name: validation
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+ num_bytes: 454862268
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+ num_examples: 39775
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+ download_size: 1889271320
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+ dataset_size: 18227277035
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+ configs:
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+ - config_name: default
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+ data_files:
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+ - split: train
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+ path: data/train-*
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+ - split: validation
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+ path: data/validation-*
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  ---
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