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Improve pdb_mkensemble to work as lib #147

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joaomcteixeira opened this issue Oct 5, 2022 · 0 comments
Open

Improve pdb_mkensemble to work as lib #147

joaomcteixeira opened this issue Oct 5, 2022 · 0 comments
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@joaomcteixeira
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Currently, pdb_mkensemble requires file paths to work, which means the pdb_mkensemble.run function cannot take a list of lists (or similar iterators) to make an ensemble. This makes the tool not fully compatible with the lib mode.

To do: improve the pdb_mkensemble.run function to accept a list of lists (of lines) at the same time it can accept file paths.

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