source: trunk/GSASIIphsGUI.py

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Diff Rev Age Author Log Message
(edit) @4899   19 months vondreele use ValidatedTxtCtrl? in MultiDataDialog? Let ValidatedTxtCtrl? use …
(edit) @4881   20 months vondreele color nonpositive definita thermal parameters in red in Atom list
(edit) @4855   21 months vondreele Add new option to AtomModify? in G2phsGUI - 'Uij' - converts Uiso to …
(edit) @4849   21 months toby apply symmetry constraints on rigid body origin; show position vars …
(edit) @4847   21 months vondreele Add (TBD) hide/showtoggle for single crystal systematic extinctions in …
(edit) @4839   21 months vondreele change formatting for scale/phase fraction in G2ddataGUI & G2strIO now …
(edit) @4838   21 months vondreele comment out MakeDrawAtom? in G2constrGUI & make the call to …
(edit) @4836   21 months vondreele Change status bar to show useful message about right click when …
(edit) @4833   21 months toby popup menu for GSGrids; split off sequential display; rename File menu …
(edit) @4829   21 months toby minor bugs: site sym for wrong RB; GUI stuff; force RB edit before …
(edit) @4828   21 months vondreele another fix to delete vector RB
(edit) @4827   21 months vondreele fix bug deleting vector RB
(edit) @4825   21 months toby remove unused & deleted hists from seq ref; option to remove hists …
(edit) @4824   22 months vondreele add new refinable RB parameter for atom site fraction - always there; …
(edit) @4820   22 months vondreele remove masks from argument list for MakeGainMap? - not used Tweak gain …
(edit) @4819   22 months toby seq ref: fix & edit phase vars for 1 hist; spyder conveniences; …
(edit) @4818   22 months vondreele Add new routine RBsymCheck to G2lat - it checks RB atom positions for …
(edit) @4816   22 months vondreele fix crash in RepaintRBInfo for Vector RBs
(edit) @4815   22 months vondreele fix problem of shifting RB origin; changed atom fractions!
(edit) @4813   22 months toby Add 'V' option (vector only) for rigid body fitting
(edit) @4812   22 months vondreele Add Cycle XYZ button on residue RB GUI & add description to help text …
(edit) @4811   22 months toby more wx4.1 & help button fixes; fix OnLeave? if called when a window is …
(edit) @4809   22 months toby display more Residue rigid body info; better docs
(edit) @4803   22 months toby don't reuse dataWindow sizer for background or PWDR; plotting: reset f …
(edit) @4801   22 months toby Cleanup deleted hists in Phase/data; improve help button location; …
(edit) @4789   22 months toby switch to new HessianLSQ; Ouch#4 msg in GUI; misc wx4.1 fixes; docs …
(edit) @4783   22 months toby wx4.1 updates; new CIF data item; scripting: peak fit details …
(edit) @4763   23 months vondreele cleanup tif import for PIL use - remove commented lines move …
(edit) @4759   23 months toby wx4.1 & mpl3.3 fixes
(edit) @4719   2 years vondreele add number/cell to site fraction apportion routine
(edit) @4672   2 years vondreele remove all wx.ALIGN from wx Add with wx.EXPAND - invalid combination …
(edit) @4669   2 years vondreele Add '?' help button to upper right for phase tabs General, etc.
(edit) @4663   2 years vondreele remove unused line
(edit) @4660   2 years vondreele Add atom site fraction calculator for 2 atom shared sites
(edit) @4659   2 years toby extensive Origin 1->2 updates; merge SetupGeneral? into a single …
(edit) @4654   2 years toby new video tutorial; misc minor RB GUI fixes for Windows; option to …
(edit) @4647   2 years vondreele fix escape seq in G2ctrlGUI add defaults for map slice color contours; …
(edit) @4641   2 years vondreele add color contouring to map slice display. Will plot lines, colors or …
(edit) @4634   2 years vondreele fix crash on unknown rId in plot inv pole figure change CF map roll …
(edit) @4624   2 years toby improve rigid body stuff; finish tutorial
(edit) @4623   2 years vondreele fix a wx.Dialog call; change "label=" to "title="
(edit) @4618   2 years vondreele Update RB atom site frac when origin of RB is shifted from one …
(edit) @4616   2 years vondreele fix a bunch of escape sequence '\' to ' ' in G2obj Add display of …
(edit) @4615   2 years toby Add DrawAtoms_default config option to set default drawing type; add …
(edit) @4614   2 years vondreele provide protection for acosd in RotateRBXYZ & UpdateRBXYZ Add sitesym …
(edit) @4613   2 years vondreele fix Origin selection wo atom selection bug in OnAssignRB
(edit) @4612   2 years vondreele change 'Process' to 'Update'
(edit) @4610   2 years vondreele change column headiings in OnRBAssign table from 'phase...' to …
(edit) @4608   2 years vondreele split VectorRB listings up into separate views for each RB in both …
(edit) @4605   2 years toby fix AddRB with no matchTable
(edit) @4602   2 years vondreele add molecular (RB) center option
(edit) @4601   2 years toby message to replace add RB table
(edit) @4600   2 years toby remove adding atoms warning; fix body fitting bugs
(edit) @4599   2 years toby remove RB match box when no atoms can be matched
(edit) @4598   2 years vondreele cosmetic changes
(edit) @4597   2 years toby add x+y and x+y+z as RB axes; move widget storage
(edit) @4595   2 years toby add RB sym axis; implement in RB add; minor RB GUI reorg
(edit) @4594   2 years vondreele remove WACV,wx.ALIGN_CENTER_VERTICAL from all Add for wx.VERTICAL …
(edit) @4583   2 years toby revise graphics & input for Insert Rigid Body
(edit) @4573   2 years toby RB extensions and minor bug fixes
(edit) @4570   2 years vondreele Implement arc mask method for determining polarization with scipy …
(edit) @4568   2 years vondreele cleanup of RollMap? command
(edit) @4564   2 years vondreele add Roll Map capability to Map Peaks menu - only for charge flip maps
(edit) @4563   2 years vondreele fix off-by-one error in Map Peaks Invert Map Peaks operation; NB: …
(edit) @4561   2 years vondreele invoke scrooling set for atom editing
(edit) @4559   2 years vondreele fix OnTransform? - the ending block of code needed to be tabbed out one …
(edit) @4558   2 years vondreele include vacancies in atom-atom table of bond limits - needed by RMCProfile
(edit) @4556   2 years vondreele Change color of As from "blue" to "orange". Implement a sampling …
(edit) @4553   2 years vondreele reimplement new PeaksUnique? code & make more general. Now finds unique …
(edit) @4551   2 years toby fix name wipe out bug
(edit) @4550   2 years vondreele use AddToNotebook? for Fourier map creation
(edit) @4547   2 years vondreele AddToNotebook? routine added & implemented for peakfit & charge flipping
(edit) @4532   2 years toby refactor ViewLSparms; more fullrmc work
(edit) @4525   2 years toby add reload to draw atoms
(edit) @4524   2 years toby rigid bodies: error on duplicate name; update draw atoms after adding …
(edit) @4523   2 years toby more fullrmc work, but not done
(edit) @4518   2 years toby start on fullrmc update for 5.0; fix for rigid bodies
(edit) @4513   2 years vondreele fix problem after setting 1-->2 transformation. A block of code …
(edit) @4508   2 years vondreele fix the select tab menu list in phases
(edit) @4507   2 years vondreele alow plotting of non integer HKL planes make planes partially …
(edit) @4505   2 years toby more fixes to Res RB edit; tweak RB atom assignment displays
(edit) @4504   2 years toby restore error for deleting RB atoms
(edit) @4503   2 years toby fix problems wit multiple instances of a single RB and with adding …
(edit) @4502   2 years vondreele Eliminate the Hatom radius & moved Bond search factor to be under Bond …
(edit) @4501   2 years vondreele move void plotting to be before slice plotting so that voids behind …
(edit) @4500   2 years toby Add sphere of atoms arround view point; show distances to peaks and …
(edit) @4499   2 years toby Add sphere of atoms arround view point; show distances to peaks and …
(edit) @4494   2 years vondreele make voids permanent,add show options for map & voids, draw voids as …
(edit) @4493   2 years vondreele strip valences from atoms in RMCProfile & fullrmc - both are blind to …
(edit) @4492   2 years vondreele cleanup here & there
(edit) @4491   2 years toby Add VoidMap?; change min/max in ValidatedTextCtrl? to xmin/xmax; new …
(edit) @4489   2 years vondreele further fixup of incommensurate mag moment drawings. Now correct.
(edit) @4487   2 years toby abort on Complete Molecule optional; bypass decode error
(edit) @4484   2 years vondreele fix setting RB thermal to 'None' replace call to …
(edit) @4479   2 years toby changes to unique map peaks & plotting after selection
(edit) @4476   2 years vondreele make sure if Uij = None that it is zero, type is 'I' and that after a …
(edit) @4473   2 years toby allow adding of rigid body atoms to atoms list
(edit) @4471   2 years vondreele restore FillCoordSphere? from G2 version #4379
(edit) @4470   2 years vondreele Add option to fade by 50% symmetry equivalent atoms, bonds, etc. in …
(edit) @4468   2 years toby add status msg on Shift-Click atom selection; error message with RB …
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