Changeset 4659 for trunk/GSASIIdataGUI.py

Timestamp:

Nov 21, 2020 2:15:49 PM (2 years ago)

Author:

toby

Message:

extensive Origin 1->2 updates; merge SetupGeneral? into a single routine in G2Elem; read sym ops from CIF; fix sites sym/mult after cood xform

File:

• trunk/GSASIIdataGUI.py (modified) (1 diff)

trunk/GSASIIdataGUI.py

@@ -1127 +1127 @@
             rd.Phase['General']['Name'] = G2obj.MakeUniqueLabel(PhaseName,phaseNameList)
             if rd.Phase['General']['SGData']['SpGrp'] in G2spc.spg2origins:
-                wx.MessageDialog(self,' The atom positions for this structure must be in the 2nd setting for the space group '+
-                    rd.Phase['General']['SGData']['SpGrp'], 
-                    'Is this 2nd setting?',  wx.OK).ShowModal()
-                
+                choice = G2G.ChooseOrigin(self,rd)
+                if choice is None: return # dialog cancelled
+                rd.Phase = choice
             PhaseName = rd.Phase['General']['Name'][:]
             newPhaseList.append(PhaseName)