source: trunk

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Diff Rev Age Author Log Message
(edit) @5108   4 years vondreele Add tests to transformation matrix in TransformDialog?; returns None if bad.
(edit) @5107   4 years vondreele fix instrument parameter file prep for x-ray data in RMCProfile
(edit) @5106   4 years vondreele modifications to handle sequential PDFfit analysis & plot the results. …
(edit) @5105   4 years vondreele fix monoclinic b form for CellDijCorr? line 275; missing last zero.
(edit) @5104   4 years toby fix misc. sphinx-docs formatting
(edit) @5102   4 years toby note 2021 or later OriginPro? requirement
(edit) @5101   4 years vondreele fix typo in line 4435 Origin stuff
(edit) @5100   4 years toby make sure excludeMode is initialized
(edit) @5099   4 years toby fix: seq hist template now saved; delay file open
(edit) @5098   4 years toby correct additional of cell type in indexing
(edit) @5097   4 years vondreele Add message for when PDFfit2 is missing or unavailable.
(edit) @5096   4 years vondreele add stripped down windows version (no Tests) of diffpy to GSAS-II …
(edit) @5095   4 years vondreele fix RESO in export MTZ
(edit) @5094   4 years vondreele fix issues in export MTZ. Make F as default (instead of F2)
(edit) @5090   4 years vondreele add MTZ exporter for both F2 and F options. The F style MTZ file can …
(edit) @5086   4 years toby more mmCIF seqCIF work: export used hists, fix R-factor reporting, …
(edit) @5085   4 years toby more mmCIF fixes; combine Overall & Phase blocks where single-phase
(edit) @5084   4 years toby update PWDR help btn formatting; compute changes to peak values …
(edit) @5083   4 years toby fix scaling of ISODISTORT displacement modes so esds are correct; …
(edit) @5082   4 years toby fix scaling of ISODISTORT displacement modes so esds are correct; …
(edit) @5081   4 years toby mmCIF export: more atoms table tweaks
(edit) @5080   4 years toby mmCIF export: histogram info
(edit) @5079   4 years toby mmCIF export: more work on atoms table
(edit) @5078   4 years toby start on mmCIF export
(edit) @5077   4 years vondreele make all plot line widths in PlotPatterns? = 1.5. This looks best.
(edit) @5076   4 years vondreele powder plots are now '+' or lines; not combined for the obs data.
(edit) @5075   4 years vondreele finish 1st attempt at GSAS-II to PDFfit interface - it seems to work.
(edit) @5074   4 years toby allow older Python -- fixed
(edit) @5073   4 years toby allow older Python
(edit) @5072   4 years toby cleanup indexing of phases/hists
(edit) @5071   4 years vondreele Add 'Temp' to PDF controls - needed for future se. PDFfit fix bugs in …
(edit) @5070   4 years toby ISO: add show mode defs; create CIF for ISO calc; remove ISO calc from …
(edit) @5069   4 years toby Make svn location a config option
(edit) @5068   4 years toby add Run ISODISTORT to menu for ISODISTORT tab; allow it to be rerun
(edit) @5067   4 years toby ISODISTORT mode/displacement fixes; allow indexing of all Phases where …
(edit) @5066   4 years vondreele fixes to RMCProfile stuff to accomodate creation of vacancies in …
(edit) @5065   4 years vondreele remove check on Histograms & Phases in beginning of UpdateConstraints? …
(edit) @5064   4 years vondreele
(edit) @5063   4 years toby Start on isodisplace import cleanup & formatting; plotting changes for …
(edit) @5062   4 years toby Start on isodisplace import cleanup & formatting; plotting changes for …
(edit) @5061   4 years vondreele remove misused WACV in ISODISTORT stuff
(edit) @5060   4 years vondreele finish drawing of distortion modes as user adjusted.
(edit) @5059   4 years vondreele patch for missing metadata for PDFfit fix (again) the Va_ neutron …
(edit) @5058   4 years vondreele provide sliders for mode displacements - not connected yet
(edit) @5057   4 years vondreele cleanup ISODISTORT references in constraints & its phase tab …
(edit) @5056   4 years vondreele add message boxes to ISODISTORT stuff
(edit) @5055   4 years vondreele Add 'Va' to blen table - already had 'Va_'
(edit) @5054   4 years vondreele place run ISODISTORT in General/Compute? menu Create interface to …
(edit) @5052   4 years toby Update PSD model in FPA code/docs; minor changes in comments
(edit) @5051   4 years toby FPA help updates; misc minor fixes
(edit) @5050   4 years vondreele further progress on PDFfit interface fix formats in RMCProfile setup.
(edit) @5049   4 years vondreele split the mainSizer in UpdateRMC into 3 sub sizers: …
(edit) @5048   4 years toby better formatting for PWDR windows and help
(edit) @5047   4 years toby CIF export fixes; work around for IsModified?() not showing changes
(edit) @5046   4 years toby suppress breakpoint() unless inside spyder or debug mode is set; …
(edit) @5045   4 years vondreele Add plotting of results after a PDFfit run.
(edit) @5044   4 years vondreele implement copy of LeBail? F0 & Fc from previous histogram in a …
(edit) @5043   4 years vondreele Add ISODISTORT menu option to RMC menu; active only for PDFfit (under …
(edit) @5042   4 years toby implement sequential CIF export; minor CIF bug fixes; add su to seq …
(edit) @5041   4 years vondreele begin to add PDFfit to RMC stuff
(edit) @5040   4 years toby fix sym-gen constraint display
(edit) @5038   4 years toby Major revision to constraints including an update to the Sequential …
(edit) @5037   4 years vondreele add use GPU option for running RMCProfile remove scrolled sub panels …
(edit) @5029   4 years vondreele upper limit on crystallite size = 10 (it was 4) consolidate import …
(edit) @5028   4 years vondreele remove another misused wx.CallAfter? in OnRefine? small change to one of …
(edit) @5026   4 years vondreele fixes to LeBail?: remove the wx.CallAfter? - undesirable effects clear …
(edit) @5025   4 years vondreele Add shell plots to 3D reflection plots. Fix escape character issues …
(edit) @5023   4 years toby fixes for Origin export & additions to tutorial; fix tutorial image flags
(edit) @5022   4 years toby Add originpro export from Conrad Gillard (conrad.gillard@…); …
(edit) @5021   4 years vondreele use copy.deepcopy on element info in PDF stuff to avoid cross talk …
(edit) @5020   4 years toby index changes for CCTBX; new scrolled output routine; document …
(edit) @5019   4 years vondreele revise qdata import; rescale by 100 & suppress nans
(edit) @5018   4 years vondreele do np.nan_to_num on xye to avoid nans in plotting arrays. remove extra …
(edit) @5017   4 years vondreele modify xye importer to use qye data from POWGEN CW processing; assumes …
(edit) @5016   4 years vondreele Add missing Gonio. Radius to pink beam Sample parms. Minor fixes to …
(edit) @5015   4 years vondreele changes to comments
(edit) @5014   4 years toby fix extra comma & relabel fixed bkg file
(edit) @5013   4 years vondreele remove invalid plot drag message - just console clutter current best …
(edit) @5012   4 years vondreele incommensurate mag str fctr correct for MnWO4
(edit) @5011   4 years vondreele incommensurate magnetic structure factors very close to correct
(edit) @5010   4 years vondreele Add 3 default items to Data in ImportImage? base class
(edit) @5009   4 years vondreele add 'det2thet' to image importers data dict.
(edit) @5008   4 years vondreele fix bug in G2plot for missing g(R) plot fix SingleFloatDialog? "format" …
(edit) @5007   4 years toby try to fix broken windows build
(edit) @5006   4 years toby try to fix broken windows build
(edit) @5005   4 years vondreele fix bug for image plate transmission in PDF calcs. (default=0.3 now - …
(edit) @5004   4 years toby better msg on Hessian refine w/0 vars; clean up docs
(edit) @5003   4 years toby redo LeBail? msg to show up only after screen paint & only show what is …
(edit) @5002   4 years vondreele allow constraints between like Debye & Bragg peak parameters.
(edit) @5001   4 years vondreele best incommensurate mag. struct. fctrs. so far but still not right.
(edit) @5000   4 years toby deal with deleting histograms from tree w/sequential fits
(edit) @4999   4 years vondreele change incommensurate magneti str. fctr. equations avoid search for …
(edit) @4998   4 years toby partial fix of magnetic constraints (still need to deal w/unvaried …
(edit) @4997   4 years vondreele move imports to top of G2ctrlGUi code so debugger can find it fix …
(edit) @4995   4 years vondreele
(edit) @4994   4 years toby fix proxy from env var
(edit) @4992   4 years vondreele some incomm. mag. str changes fix BondRadii? issue in structure drawing …
(edit) @4991   4 years toby more wx4.1 fixes (PDF controls mostly)
(edit) @4990   4 years toby renumber ouches to keep unique; give timing on ouch 4
(edit) @4989   4 years toby more proxy stuff
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