diff --git a/common/python/nomadcore/md_data_access/MDDataAccess.py b/common/python/nomadcore/md_data_access/MDDataAccess.py index 4e14ba8f6e965216e02233974a21827de145b96f..d2104024f66f9ef3cdeb767c58dd73e81af00730 100644 --- a/common/python/nomadcore/md_data_access/MDDataAccess.py +++ b/common/python/nomadcore/md_data_access/MDDataAccess.py @@ -3653,7 +3653,7 @@ class MDDataAccess(object): return topology - def load_mdanalysis_topology(self, file_format): + def load_mdanalysis_topology(self, file_format=None): """ Support level for MDAnalysis package If filename is given, we try loading the format, if its a trajectory @@ -3666,7 +3666,10 @@ class MDDataAccess(object): topology = None universe = None - fileformat = re.sub('[.]', '', file_format) + if file_format: + fileformat = re.sub('[.]', '', file_format) + else: + fileformat = file_format top=self.topofile if top: try: