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translate arctic3d results to an input pdb #378

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mgiulini opened this issue Jan 24, 2024 · 0 comments
Open

translate arctic3d results to an input pdb #378

mgiulini opened this issue Jan 24, 2024 · 0 comments
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@mgiulini
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given an arctic3d run, it would be useful to translate the retrieved data into an input pdb file. This requires:

  • the alignment of the input pdb file with the query pdb used in the computation
  • the conversion of the data based on this alignment
@mgiulini mgiulini self-assigned this Jan 24, 2024
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