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Fix space in file names
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@ -69,7 +69,7 @@ class dataFileBase(object):
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subpath=datadir/self.GetFileType().name.lower()
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if not subpath.exists():
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subpath.mkdir()
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file=subpath/"{}_{}_{}.dat".format(self.molecule.lower(),self.method.name,self.method.basis)
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file=subpath/"{}_{}_{}.dat".format(self.molecule.lower().replace(" ","_"),self.method.name,self.method.basis)
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if not file.exists():
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with file.open("w") as f:
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for key,value in self.getMetadata().items():
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