source: trunk

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Diff Rev Age Author Log Message
(edit) @5090   10 months vondreele add MTZ exporter for both F2 and F options. The F style MTZ file can …
(edit) @5086   10 months toby more mmCIF seqCIF work: export used hists, fix R-factor reporting, …
(edit) @5085   10 months toby more mmCIF fixes; combine Overall & Phase blocks where single-phase
(edit) @5084   11 months toby update PWDR help btn formatting; compute changes to peak values …
(edit) @5083   11 months toby fix scaling of ISODISTORT displacement modes so esds are correct; …
(edit) @5082   11 months toby fix scaling of ISODISTORT displacement modes so esds are correct; …
(edit) @5081   11 months toby mmCIF export: more atoms table tweaks
(edit) @5080   11 months toby mmCIF export: histogram info
(edit) @5079   11 months toby mmCIF export: more work on atoms table
(edit) @5078   11 months toby start on mmCIF export
(edit) @5077   11 months vondreele make all plot line widths in PlotPatterns? = 1.5. This looks best.
(edit) @5076   11 months vondreele powder plots are now '+' or lines; not combined for the obs data.
(edit) @5075   11 months vondreele finish 1st attempt at GSAS-II to PDFfit interface - it seems to work.
(edit) @5074   11 months toby allow older Python -- fixed
(edit) @5073   11 months toby allow older Python
(edit) @5072   11 months toby cleanup indexing of phases/hists
(edit) @5071   11 months vondreele Add 'Temp' to PDF controls - needed for future se. PDFfit fix bugs in …
(edit) @5070   11 months toby ISO: add show mode defs; create CIF for ISO calc; remove ISO calc from …
(edit) @5069   11 months toby Make svn location a config option
(edit) @5068   11 months toby add Run ISODISTORT to menu for ISODISTORT tab; allow it to be rerun
(edit) @5067   11 months toby ISODISTORT mode/displacement fixes; allow indexing of all Phases where …
(edit) @5066   11 months vondreele fixes to RMCProfile stuff to accomodate creation of vacancies in …
(edit) @5065   11 months vondreele remove check on Histograms & Phases in beginning of UpdateConstraints?
(edit) @5064   11 months vondreele
(edit) @5063   11 months toby Start on isodisplace import cleanup & formatting; plotting changes for …
(edit) @5062   11 months toby Start on isodisplace import cleanup & formatting; plotting changes for …
(edit) @5061   11 months vondreele remove misused WACV in ISODISTORT stuff
(edit) @5060   11 months vondreele finish drawing of distortion modes as user adjusted.
(edit) @5059   11 months vondreele patch for missing metadata for PDFfit fix (again) the Va_ neutron …
(edit) @5058   11 months vondreele provide sliders for mode displacements - not connected yet
(edit) @5057   11 months vondreele cleanup ISODISTORT references in constraints & its phase tab …
(edit) @5056   11 months vondreele add message boxes to ISODISTORT stuff
(edit) @5055   11 months vondreele Add 'Va' to blen table - already had 'Va_'
(edit) @5054   11 months vondreele place run ISODISTORT in General/Compute? menu Create interface to …
(edit) @5052   11 months toby Update PSD model in FPA code/docs; minor changes in comments
(edit) @5051   11 months toby FPA help updates; misc minor fixes
(edit) @5050   11 months vondreele further progress on PDFfit interface fix formats in RMCProfile setup.
(edit) @5049   11 months vondreele split the mainSizer in UpdateRMC into 3 sub sizers: …
(edit) @5048   11 months toby better formatting for PWDR windows and help
(edit) @5047   12 months toby CIF export fixes; work around for IsModified?() not showing changes
(edit) @5046   12 months toby suppress breakpoint() unless inside spyder or debug mode is set; …
(edit) @5045   12 months vondreele Add plotting of results after a PDFfit run.
(edit) @5044   12 months vondreele implement copy of LeBail? F0 & Fc from previous histogram in a …
(edit) @5043   12 months vondreele Add ISODISTORT menu option to RMC menu; active only for PDFfit (under …
(edit) @5042   12 months toby implement sequential CIF export; minor CIF bug fixes; add su to seq …
(edit) @5041   12 months vondreele begin to add PDFfit to RMC stuff
(edit) @5040   12 months toby fix sym-gen constraint display
(edit) @5038   12 months toby Major revision to constraints including an update to the Sequential …
(edit) @5037   12 months vondreele add use GPU option for running RMCProfile remove scrolled sub panels …
(edit) @5029   12 months vondreele upper limit on crystallite size = 10 (it was 4) consolidate import …
(edit) @5028   12 months vondreele remove another misused wx.CallAfter? in OnRefine? small change to one of …
(edit) @5026   12 months vondreele fixes to LeBail?: remove the wx.CallAfter? - undesirable effects clear …
(edit) @5025   13 months vondreele Add shell plots to 3D reflection plots. Fix escape character issues …
(edit) @5023   13 months toby fixes for Origin export & additions to tutorial; fix tutorial image flags
(edit) @5022   13 months toby Add originpro export from Conrad Gillard (conrad.gillard@…); …
(edit) @5021   13 months vondreele use copy.deepcopy on element info in PDF stuff to avoid cross talk …
(edit) @5020   13 months toby index changes for CCTBX; new scrolled output routine; document …
(edit) @5019   13 months vondreele revise qdata import; rescale by 100 & suppress nans
(edit) @5018   13 months vondreele do np.nan_to_num on xye to avoid nans in plotting arrays. remove extra …
(edit) @5017   13 months vondreele modify xye importer to use qye data from POWGEN CW processing; assumes …
(edit) @5016   13 months vondreele Add missing Gonio. Radius to pink beam Sample parms. Minor fixes to …
(edit) @5015   13 months vondreele changes to comments
(edit) @5014   13 months toby fix extra comma & relabel fixed bkg file
(edit) @5013   13 months vondreele remove invalid plot drag message - just console clutter current best …
(edit) @5012   14 months vondreele incommensurate mag str fctr correct for MnWO4
(edit) @5011   14 months vondreele incommensurate magnetic structure factors very close to correct
(edit) @5010   14 months vondreele Add 3 default items to Data in ImportImage? base class
(edit) @5009   14 months vondreele add 'det2thet' to image importers data dict.
(edit) @5008   14 months vondreele fix bug in G2plot for missing g(R) plot fix SingleFloatDialog? "format" …
(edit) @5007   14 months toby try to fix broken windows build
(edit) @5006   14 months toby try to fix broken windows build
(edit) @5005   14 months vondreele fix bug for image plate transmission in PDF calcs. (default=0.3 now - …
(edit) @5004   14 months toby better msg on Hessian refine w/0 vars; clean up docs
(edit) @5003   14 months toby redo LeBail? msg to show up only after screen paint & only show what is …
(edit) @5002   14 months vondreele allow constraints between like Debye & Bragg peak parameters.
(edit) @5001   14 months vondreele best incommensurate mag. struct. fctrs. so far but still not right.
(edit) @5000   14 months toby deal with deleting histograms from tree w/sequential fits
(edit) @4999   14 months vondreele change incommensurate magneti str. fctr. equations avoid search for …
(edit) @4998   14 months toby partial fix of magnetic constraints (still need to deal w/unvaried …
(edit) @4997   15 months vondreele move imports to top of G2ctrlGUi code so debugger can find it fix …
(edit) @4995   15 months vondreele
(edit) @4994   15 months toby fix proxy from env var
(edit) @4992   15 months vondreele some incomm. mag. str changes fix BondRadii? issue in structure drawing …
(edit) @4991   15 months toby more wx4.1 fixes (PDF controls mostly)
(edit) @4990   15 months toby renumber ouches to keep unique; give timing on ouch 4
(edit) @4989   15 months toby more proxy stuff
(edit) @4988   15 months vondreele minor fixes to Plot Control GUI
(edit) @4987   15 months toby duplicate Seq->csv export; set svn proxy from environment variables
(edit) @4986   15 months vondreele change slider controls for Plot Controls - add editable value field.
(edit) @4985   15 months vondreele fix mag sp gp special pos determination for P3m1 & P321 mag groups.
(edit) @4984   15 months vondreele fix excluded regions for q- & d-plots
(edit) @4983   15 months toby fix initialization problem when EQUIV are changed to constraints; …
(edit) @4982   15 months toby fix check on non-zero multipliers
(edit) @4981   15 months vondreele modify mag str fctr math. fix bug in PlotCovariance? - labels needed to …
(edit) @4980   15 months toby Fix coeff. display for EQUIV
(edit) @4979   15 months vondreele add new function UpdateSelection?() to G2TreeCtrl, used it in a few …
(edit) @4978   15 months vondreele fix to UpdateHKLFdata to include sg extinct flag for each reflection
(edit) @4977   15 months vondreele fix bad crash (blown out of python!) in OnDataDelete?. Remove CallAfter?
(edit) @4976   15 months toby Mac M1 changes
(edit) @4974   15 months vondreele fix single crystal merge routines (missing Instrument Parameters) add …
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