Fix a bug in StructureSimilarity.py

DeepRank / pdb2sql

Fast and versatile biomolecular structure PDB file parser using SQL queries

https://pdb2sql.readthedocs.io

Apache License 2.0

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Fix a bug in StructureSimilarity.py #68

Closed DarioMarzella closed 3 years ago

DarioMarzella commented 3 years ago

In line 577, when trying to call self.get_identical_atoms, the chain ID was not specified, causing StructureSimilarity to crash in case the statement at line 577 would return True.

NicoRenaud commented 3 years ago

Thanks !