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  1. .gitattributes +21 -0
  2. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/11 +3 -0
  3. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/12 +3 -0
  4. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/15 +3 -0
  5. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/16 +3 -0
  6. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/17 +3 -0
  7. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/20 +3 -0
  8. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/21 +3 -0
  9. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/22 +3 -0
  10. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/23 +3 -0
  11. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/24 +3 -0
  12. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/4 +3 -0
  13. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/5 +3 -0
  14. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/6 +3 -0
  15. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/7 +3 -0
  16. fullC/p2/pdb_pockets_300K/group_000.zarr/cmo_a/c/8 +3 -0
  17. fullC/p2/pdb_pockets_300K/group_000.zarr/eps_a/c/0 +3 -0
  18. fullC/p2/pdb_pockets_300K/group_000.zarr/fock_a/c/12 +3 -0
  19. fullC/p2/pdb_pockets_300K/group_000.zarr/fock_a/c/4 +3 -0
  20. fullC/p2/pdb_pockets_300K/group_000.zarr/fock_a/c/5 +3 -0
  21. fullC/p2/pdb_pockets_300K/group_000.zarr/fock_a/c/6 +3 -0
  22. fullC/p2/pdb_pockets_300K/group_000.zarr/pair_loewdin_bo_index/c/0/0 +3 -0
  23. occC/p2/ml_protein_interface/group_000.zarr/atom_offsets/c/0 +0 -0
  24. occC/p2/ml_protein_interface/group_000.zarr/flags/c/0/0 +0 -0
  25. occC/p2/ml_protein_interface/group_000.zarr/gbw_eps_a_offsets/c/0 +0 -0
  26. occC/p2/ml_protein_interface/group_000.zarr/gbw_occ_a_offsets/c/0 +0 -0
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  30. occC/p2/ml_protein_interface/group_000.zarr/occ_a/c/0 +0 -0
  31. occC/p2/ml_protein_interface/group_000.zarr/pair_loewdin_bo_offsets/c/0 +0 -0
  32. occC/p2/ml_protein_interface/group_000.zarr/pair_mayer_bo_offsets/c/0 +0 -0
  33. occC/p2/ml_protein_interface/group_000.zarr/pair_mulliken_ovlp_offsets/c/0 +0 -0
  34. occC/p2/ml_protein_interface/group_000.zarr/scalar_i/c/0/0 +0 -0
  35. occC/p2/ml_protein_interface/group_001.zarr/atom_f8/zarr.json +68 -0
  36. occC/p2/ml_protein_interface/group_001.zarr/atom_offsets/zarr.json +65 -0
  37. occC/p2/ml_protein_interface/group_001.zarr/atom_shell/zarr.json +68 -0
  38. occC/p2/ml_protein_interface/group_001.zarr/atom_z/c/0 +0 -0
  39. occC/p2/ml_protein_interface/group_001.zarr/atom_z/zarr.json +65 -0
  40. occC/p2/ml_protein_interface/group_001.zarr/cmo_a/zarr.json +55 -0
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  45. occC/p2/ml_protein_interface/group_001.zarr/eps_a/zarr.json +65 -0
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  49. occC/p2/ml_protein_interface/group_001.zarr/eps_b_offsets/zarr.json +65 -0
  50. occC/p2/ml_protein_interface/group_001.zarr/flags/zarr.json +65 -0
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+ "configuration": {
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+ "endian": "little"
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+ }
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+ },
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+ {
54
+ "name": "crc32c"
55
+ }
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+ ],
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+ "index_location": "end"
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+ }
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+ }
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+ ],
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+ "attributes": {},
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+ "zarr_format": 3,
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+ "node_type": "array",
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+ "storage_transformers": []
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+ }