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  1. .gitattributes +3 -1
  2. TDC/DrugADMET/Ames/test.csv +3 -0
  3. TDC/DrugADMET/Ames/test.jsonl +3 -0
  4. TDC/DrugADMET/Ames/train.csv +3 -0
  5. TDC/DrugADMET/Ames/train.jsonl +3 -0
  6. TDC/DrugADMET/Ames/valid.csv +3 -0
  7. TDC/DrugADMET/Ames/valid.jsonl +3 -0
  8. TDC/DrugADMET/BBB/test.csv +3 -0
  9. TDC/DrugADMET/BBB/test.jsonl +3 -0
  10. TDC/DrugADMET/BBB/train.csv +3 -0
  11. TDC/DrugADMET/BBB/train.jsonl +3 -0
  12. TDC/DrugADMET/BBB/valid.csv +3 -0
  13. TDC/DrugADMET/BBB/valid.jsonl +3 -0
  14. TDC/DrugADMET/Bioavailability/test.csv +3 -0
  15. TDC/DrugADMET/Bioavailability/test.jsonl +3 -0
  16. TDC/DrugADMET/Bioavailability/train.csv +3 -0
  17. TDC/DrugADMET/Bioavailability/train.jsonl +3 -0
  18. TDC/DrugADMET/Bioavailability/valid.csv +3 -0
  19. TDC/DrugADMET/Bioavailability/valid.jsonl +3 -0
  20. TDC/DrugADMET/CYP2C9 inhibition/test.csv +3 -0
  21. TDC/DrugADMET/CYP2C9 inhibition/test.jsonl +3 -0
  22. TDC/DrugADMET/CYP2C9 inhibition/train.csv +3 -0
  23. TDC/DrugADMET/CYP2C9 inhibition/train.jsonl +3 -0
  24. TDC/DrugADMET/CYP2C9 inhibition/valid.csv +3 -0
  25. TDC/DrugADMET/CYP2C9 inhibition/valid.jsonl +3 -0
  26. TDC/DrugADMET/CYP2C9 substrate/test.csv +3 -0
  27. TDC/DrugADMET/CYP2C9 substrate/test.jsonl +3 -0
  28. TDC/DrugADMET/CYP2C9 substrate/train.csv +3 -0
  29. TDC/DrugADMET/CYP2C9 substrate/train.jsonl +3 -0
  30. TDC/DrugADMET/CYP2C9 substrate/valid.csv +3 -0
  31. TDC/DrugADMET/CYP2C9 substrate/valid.jsonl +3 -0
  32. TDC/DrugADMET/CYP2D6 inhibition/test.csv +3 -0
  33. TDC/DrugADMET/CYP2D6 inhibition/test.jsonl +3 -0
  34. TDC/DrugADMET/CYP2D6 inhibition/train.csv +3 -0
  35. TDC/DrugADMET/CYP2D6 inhibition/train.jsonl +3 -0
  36. TDC/DrugADMET/CYP2D6 inhibition/valid.csv +3 -0
  37. TDC/DrugADMET/CYP2D6 inhibition/valid.jsonl +3 -0
  38. TDC/DrugADMET/CYP2D6 substrate/test.csv +3 -0
  39. TDC/DrugADMET/CYP2D6 substrate/test.jsonl +3 -0
  40. TDC/DrugADMET/CYP2D6 substrate/train.csv +3 -0
  41. TDC/DrugADMET/CYP2D6 substrate/train.jsonl +3 -0
  42. TDC/DrugADMET/CYP2D6 substrate/valid.csv +3 -0
  43. TDC/DrugADMET/CYP2D6 substrate/valid.jsonl +3 -0
  44. TDC/DrugADMET/CYP3A4 inhibition/test.csv +3 -0
  45. TDC/DrugADMET/CYP3A4 inhibition/test.jsonl +3 -0
  46. TDC/DrugADMET/CYP3A4 inhibition/train.csv +3 -0
  47. TDC/DrugADMET/CYP3A4 inhibition/train.jsonl +3 -0
  48. TDC/DrugADMET/CYP3A4 inhibition/valid.csv +3 -0
  49. TDC/DrugADMET/CYP3A4 inhibition/valid.jsonl +3 -0
  50. TDC/DrugADMET/CYP3A4 substrate/test.csv +3 -0
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