MantisBT - Rosetta
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|Fixed in Version
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|Fixed in SVN Version
|0000328: Ligands will all atoms incorrectly named cause Rosetta error.
|If you have a (non-polymeric) ligand in your PDB, but you don't have any of the appropriately named atoms, Rosetta will attempt to put the ligand in the pose (as opposed to discarding/ignoring it), but when it tries to fill the missing atoms it won't have anything to anchor on, so it will just spin helplessly until it errors out with a somewhat obtuse error message.
|Steps To Reproduce
|Take a structure with a non-polymeric ligand. Rename all the atoms in the PDB to something else. Try to score it in Rosetta.
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