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@rubenalv rubenalv commented Sep 1, 2023

Deprecation warning from Pandas .groupby() fixed. Added sort = False to .groupby(), so the residues in the output pdb are ordered by position (1,2,3...n) instead alphabetically (10,101,102,103...n)

Deprecation warning from Pandas `.groupby()` fixed.
Added `sort = False` to `.groupby()`, so the residues in the output pdb are ordered by position (1,2,3...n) instead alphabetically (10,101,102,103...n)
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