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[stability-calculations] Rosetta issue #65

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j0kaso opened this issue Jun 22, 2022 · 0 comments
Open

[stability-calculations] Rosetta issue #65

j0kaso opened this issue Jun 22, 2022 · 0 comments
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documentation Improvements or additions to documentation good first issue Good for newcomers Rosetta_ddG_pipeline All issues related to the rosetta ddG pipeline

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@j0kaso
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j0kaso commented Jun 22, 2022

Rosettas keep-ligand script does not tolerate lines without a chain-id (e.g. TER lines). This needs to be added before (or this script changed)

  • need to add note in the documentation/wiki

Rosetta/source/src/apps/public/relax_w_allatom_cst/clean_pdb_keep_ligand.py
@j0kaso j0kaso added documentation Improvements or additions to documentation good first issue Good for newcomers Rosetta_ddG_pipeline All issues related to the rosetta ddG pipeline labels Jun 22, 2022
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documentation Improvements or additions to documentation good first issue Good for newcomers Rosetta_ddG_pipeline All issues related to the rosetta ddG pipeline
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