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THEMol

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Size:
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Tags:
chemistry
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  1. .gitattributes +1 -0
  2. TorsionScan/torsion_0.h5 +3 -0
  3. TorsionScan/torsion_1.h5 +3 -0
  4. TorsionScan/torsion_10.h5 +3 -0
  5. TorsionScan/torsion_11.h5 +3 -0
  6. TorsionScan/torsion_12.h5 +3 -0
  7. TorsionScan/torsion_13.h5 +3 -0
  8. TorsionScan/torsion_14.h5 +3 -0
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  11. TorsionScan/torsion_17.h5 +3 -0
  12. TorsionScan/torsion_18.h5 +3 -0
  13. TorsionScan/torsion_19.h5 +3 -0
  14. TorsionScan/torsion_2.h5 +3 -0
  15. TorsionScan/torsion_20.h5 +3 -0
  16. TorsionScan/torsion_21.h5 +3 -0
  17. TorsionScan/torsion_22.h5 +3 -0
  18. TorsionScan/torsion_23.h5 +3 -0
  19. TorsionScan/torsion_24.h5 +3 -0
  20. TorsionScan/torsion_25.h5 +3 -0
  21. TorsionScan/torsion_26.h5 +3 -0
  22. TorsionScan/torsion_27.h5 +3 -0
  23. TorsionScan/torsion_28.h5 +3 -0
  24. TorsionScan/torsion_29.h5 +3 -0
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  26. TorsionScan/torsion_30.h5 +3 -0
  27. TorsionScan/torsion_31.h5 +3 -0
  28. TorsionScan/torsion_32.h5 +3 -0
  29. TorsionScan/torsion_33.h5 +3 -0
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  31. TorsionScan/torsion_35.h5 +3 -0
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  33. TorsionScan/torsion_37.h5 +3 -0
  34. TorsionScan/torsion_38.h5 +3 -0
  35. TorsionScan/torsion_39.h5 +3 -0
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  38. TorsionScan/torsion_41.h5 +3 -0
  39. TorsionScan/torsion_42.h5 +3 -0
  40. TorsionScan/torsion_43.h5 +3 -0
  41. TorsionScan/torsion_44.h5 +3 -0
  42. TorsionScan/torsion_45.h5 +3 -0
  43. TorsionScan/torsion_46.h5 +3 -0
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  47. TorsionScan/torsion_5.h5 +3 -0
  48. TorsionScan/torsion_6.h5 +3 -0
  49. TorsionScan/torsion_7.h5 +3 -0
  50. TorsionScan/torsion_8.h5 +3 -0
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