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Change thermo library commentary for liquid phase.
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connie committed Mar 31, 2015
1 parent 74e67f1 commit e19a8aa
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion rmgpy/data/thermo.py
Original file line number Diff line number Diff line change
Expand Up @@ -688,7 +688,7 @@ def getThermoDataFromLibraries(self, species, trainingSet=None):
if thermoData is not None:
assert len(thermoData) == 3, "thermoData should be a tuple at this point"
if rmgpy.rmg.main.solvent is not None and trainingSet is None:
thermoData[0].comment += 'Thermo library "corrected": ' + label
thermoData[0].comment += 'Thermo library corrected for liquid phase: ' + label
else:
thermoData[0].comment += 'Thermo library: ' + label
return thermoData
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