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support reading from PDB #12

Merged
merged 9 commits into from
Aug 21, 2023
Merged

support reading from PDB #12

merged 9 commits into from
Aug 21, 2023

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Ruibin-Liu
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Add a basic read_pdb function so that we can read the atomic information similar to that in the mmCIF category _atom_site. It reads every line starting with 'ATOM', 'HETATM', and 'TER'. By adding 'TER', it is easier to filter different chains even if they happen to have the same chain names as some program output files like that.

@Ruibin-Liu Ruibin-Liu merged commit 54abed0 into main Aug 21, 2023
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@Ruibin-Liu Ruibin-Liu deleted the pdb branch August 21, 2023 20:41
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