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tests passing checkpoint 2
1 parent 70e8403 commit 3c2073a

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Lines changed: 10 additions & 339 deletions

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src/diffpy/cmipdf/basepdfgenerator.py

Lines changed: 1 addition & 1 deletion
Original file line numberDiff line numberDiff line change
@@ -304,7 +304,7 @@ def set_structure_from_parset(self, parset, periodic=True):
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"""
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# Store the ParameterSet for easy access
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self._phase = parset
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self.structure = self._phase.structure
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self.structure = self._phase.stru
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# Put this ParameterSet in the ProfileGenerator.
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self.add_parameter_set(parset)

src/diffpy/cmipdf/pdfcontribution.py

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@@ -196,11 +196,11 @@ def addStructure(self, name, structure, periodic=True):
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"""
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# Based on periodic, create the proper generator.
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if periodic:
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from diffpy.srfit.pdf.pdfgenerator import PDFGenerator
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from diffpy.cmipdf.pdfgenerator import PDFGenerator
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gen = PDFGenerator(name)
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else:
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from diffpy.srfit.pdf.debyepdfgenerator import DebyePDFGenerator
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from diffpy.cmipdf.debyepdfgenerator import DebyePDFGenerator
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gen = DebyePDFGenerator(name)
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@@ -241,11 +241,11 @@ def addPhase(self, name, parset, periodic=True):
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"""
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# Based on periodic, create the proper generator.
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if periodic:
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from diffpy.srfit.pdf.pdfgenerator import PDFGenerator
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from diffpy.cmipdf.pdfgenerator import PDFGenerator
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gen = PDFGenerator(name)
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else:
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from diffpy.srfit.pdf.debyepdfgenerator import DebyePDFGenerator
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from diffpy.cmipdf.debyepdfgenerator import DebyePDFGenerator
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gen = DebyePDFGenerator(name)
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tests/new_test_pdf.py

Lines changed: 0 additions & 323 deletions
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