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Merge pull request #300 from OpenBioSim/fix_299
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Fix issue #299
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lohedges authored Jun 17, 2024
2 parents e877dc8 + fbe4249 commit 3df86f9
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2 changes: 1 addition & 1 deletion python/BioSimSpace/IO/_io.py
Original file line number Diff line number Diff line change
Expand Up @@ -764,7 +764,7 @@ def saveMolecules(
continue

# Add the file format to the property map.
_property_map["fileformat"] = _SireBase.wrap(format)
_property_map["fileformat"] = format

# Warn the user if any molecules are parameterised with a force field
# that uses geometric combining rules. While we can write this to file
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2 changes: 1 addition & 1 deletion python/BioSimSpace/Sandpit/Exscientia/IO/_io.py
Original file line number Diff line number Diff line change
Expand Up @@ -764,7 +764,7 @@ def saveMolecules(
continue

# Add the file format to the property map.
_property_map["fileformat"] = _SireBase.wrap(format)
_property_map["fileformat"] = format

# Warn the user if any molecules are parameterised with a force field
# that uses geometric combining rules. While we can write this to file
Expand Down

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