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  1. ATOMICA_checkpoints/ligand/metal_ions/CA/CA_v1.pt +3 -0
  2. ATOMICA_checkpoints/ligand/metal_ions/CA/CA_v1_config.json +16 -0
  3. ATOMICA_checkpoints/ligand/metal_ions/CA/CA_v2.pt +3 -0
  4. ATOMICA_checkpoints/ligand/metal_ions/CA/CA_v2_config.json +16 -0
  5. ATOMICA_checkpoints/ligand/metal_ions/CA/CA_v3.pt +3 -0
  6. ATOMICA_checkpoints/ligand/metal_ions/CA/CA_v3_config.json +16 -0
  7. ATOMICA_checkpoints/ligand/metal_ions/CO/CO_v1.pt +3 -0
  8. ATOMICA_checkpoints/ligand/metal_ions/CO/CO_v1_config.json +16 -0
  9. ATOMICA_checkpoints/ligand/metal_ions/CO/CO_v2.pt +3 -0
  10. ATOMICA_checkpoints/ligand/metal_ions/CO/CO_v2_config.json +16 -0
  11. ATOMICA_checkpoints/ligand/metal_ions/CO/CO_v3.pt +3 -0
  12. ATOMICA_checkpoints/ligand/metal_ions/CO/CO_v3_config.json +16 -0
  13. ATOMICA_checkpoints/ligand/metal_ions/CU/CU_v1.pt +3 -0
  14. ATOMICA_checkpoints/ligand/metal_ions/CU/CU_v1_config.json +16 -0
  15. ATOMICA_checkpoints/ligand/metal_ions/CU/CU_v2.pt +3 -0
  16. ATOMICA_checkpoints/ligand/metal_ions/CU/CU_v2_config.json +16 -0
  17. ATOMICA_checkpoints/ligand/metal_ions/CU/CU_v3.pt +3 -0
  18. ATOMICA_checkpoints/ligand/metal_ions/CU/CU_v3_config.json +16 -0
  19. ATOMICA_checkpoints/ligand/metal_ions/FE/FE_v1.pt +3 -0
  20. ATOMICA_checkpoints/ligand/metal_ions/FE/FE_v1_config.json +16 -0
  21. ATOMICA_checkpoints/ligand/metal_ions/FE/FE_v2.pt +3 -0
  22. ATOMICA_checkpoints/ligand/metal_ions/FE/FE_v2_config.json +16 -0
  23. ATOMICA_checkpoints/ligand/metal_ions/FE/FE_v3.pt +3 -0
  24. ATOMICA_checkpoints/ligand/metal_ions/FE/FE_v3_config.json +16 -0
  25. ATOMICA_checkpoints/ligand/metal_ions/K/K_v1.pt +3 -0
  26. ATOMICA_checkpoints/ligand/metal_ions/K/K_v1_config.json +16 -0
  27. ATOMICA_checkpoints/ligand/metal_ions/K/K_v2.pt +3 -0
  28. ATOMICA_checkpoints/ligand/metal_ions/K/K_v2_config.json +16 -0
  29. ATOMICA_checkpoints/ligand/metal_ions/K/K_v3.pt +3 -0
  30. ATOMICA_checkpoints/ligand/metal_ions/K/K_v3_config.json +16 -0
  31. ATOMICA_checkpoints/ligand/metal_ions/MG/MG_v1.pt +3 -0
  32. ATOMICA_checkpoints/ligand/metal_ions/MG/MG_v1_config.json +16 -0
  33. ATOMICA_checkpoints/ligand/metal_ions/MG/MG_v2.pt +3 -0
  34. ATOMICA_checkpoints/ligand/metal_ions/MG/MG_v2_config.json +16 -0
  35. ATOMICA_checkpoints/ligand/metal_ions/MG/MG_v3.pt +3 -0
  36. ATOMICA_checkpoints/ligand/metal_ions/MG/MG_v3_config.json +16 -0
  37. ATOMICA_checkpoints/ligand/metal_ions/MN/MN_v1.pt +3 -0
  38. ATOMICA_checkpoints/ligand/metal_ions/MN/MN_v1_config.json +16 -0
  39. ATOMICA_checkpoints/ligand/metal_ions/MN/MN_v2.pt +3 -0
  40. ATOMICA_checkpoints/ligand/metal_ions/MN/MN_v2_config.json +16 -0
  41. ATOMICA_checkpoints/ligand/metal_ions/MN/MN_v3.pt +3 -0
  42. ATOMICA_checkpoints/ligand/metal_ions/MN/MN_v3_config.json +16 -0
  43. ATOMICA_checkpoints/ligand/metal_ions/NA/NA_v1.pt +3 -0
  44. ATOMICA_checkpoints/ligand/metal_ions/NA/NA_v1_config.json +16 -0
  45. ATOMICA_checkpoints/ligand/metal_ions/NA/NA_v2.pt +3 -0
  46. ATOMICA_checkpoints/ligand/metal_ions/NA/NA_v2_config.json +16 -0
  47. ATOMICA_checkpoints/ligand/metal_ions/NA/NA_v3.pt +3 -0
  48. ATOMICA_checkpoints/ligand/metal_ions/NA/NA_v3_config.json +16 -0
  49. ATOMICA_checkpoints/ligand/metal_ions/ZN/ZN_v1.pt +3 -0
  50. ATOMICA_checkpoints/ligand/metal_ions/ZN/ZN_v1_config.json +16 -0
ATOMICA_checkpoints/ligand/metal_ions/CA/CA_v1.pt ADDED
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ATOMICA_checkpoints/ligand/metal_ions/CO/CO_v1.pt ADDED
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