source: trunk/GSASIIphsGUI.py

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Diff Rev Age Author Log Message
(edit) @4836   8 months vondreele Change status bar to show useful message about right click when …
(edit) @4833   8 months toby popup menu for GSGrids; split off sequential display; rename File menu …
(edit) @4829   8 months toby minor bugs: site sym for wrong RB; GUI stuff; force RB edit before …
(edit) @4828   8 months vondreele another fix to delete vector RB
(edit) @4827   8 months vondreele fix bug deleting vector RB
(edit) @4825   8 months toby remove unused & deleted hists from seq ref; option to remove hists …
(edit) @4824   8 months vondreele add new refinable RB parameter for atom site fraction - always there; …
(edit) @4820   8 months vondreele remove masks from argument list for MakeGainMap? - not used Tweak gain …
(edit) @4819   8 months toby seq ref: fix & edit phase vars for 1 hist; spyder conveniences; …
(edit) @4818   8 months vondreele Add new routine RBsymCheck to G2lat - it checks RB atom positions for …
(edit) @4816   8 months vondreele fix crash in RepaintRBInfo for Vector RBs
(edit) @4815   8 months vondreele fix problem of shifting RB origin; changed atom fractions!
(edit) @4813   8 months toby Add 'V' option (vector only) for rigid body fitting
(edit) @4812   8 months vondreele Add Cycle XYZ button on residue RB GUI & add description to help text …
(edit) @4811   8 months toby more wx4.1 & help button fixes; fix OnLeave? if called when a window is …
(edit) @4809   8 months toby display more Residue rigid body info; better docs
(edit) @4803   8 months toby don't reuse dataWindow sizer for background or PWDR; plotting: reset f …
(edit) @4801   8 months toby Cleanup deleted hists in Phase/data; improve help button location; …
(edit) @4789   9 months toby switch to new HessianLSQ; Ouch#4 msg in GUI; misc wx4.1 fixes; docs …
(edit) @4783   9 months toby wx4.1 updates; new CIF data item; scripting: peak fit details …
(edit) @4763   9 months vondreele cleanup tif import for PIL use - remove commented lines move …
(edit) @4759   9 months toby wx4.1 & mpl3.3 fixes
(edit) @4719   10 months vondreele add number/cell to site fraction apportion routine
(edit) @4672   10 months vondreele remove all wx.ALIGN from wx Add with wx.EXPAND - invalid combination …
(edit) @4669   11 months vondreele Add '?' help button to upper right for phase tabs General, etc.
(edit) @4663   11 months vondreele remove unused line
(edit) @4660   11 months vondreele Add atom site fraction calculator for 2 atom shared sites
(edit) @4659   11 months toby extensive Origin 1->2 updates; merge SetupGeneral? into a single …
(edit) @4654   11 months toby new video tutorial; misc minor RB GUI fixes for Windows; option to …
(edit) @4647   12 months vondreele fix escape seq in G2ctrlGUI add defaults for map slice color contours; …
(edit) @4641   12 months vondreele add color contouring to map slice display. Will plot lines, colors or …
(edit) @4634   12 months vondreele fix crash on unknown rId in plot inv pole figure change CF map roll …
(edit) @4624   12 months toby improve rigid body stuff; finish tutorial
(edit) @4623   12 months vondreele fix a wx.Dialog call; change "label=" to "title="
(edit) @4618   12 months vondreele Update RB atom site frac when origin of RB is shifted from one …
(edit) @4616   12 months vondreele fix a bunch of escape sequence '\' to ' ' in G2obj Add display of …
(edit) @4615   12 months toby Add DrawAtoms_default config option to set default drawing type; add …
(edit) @4614   12 months vondreele provide protection for acosd in RotateRBXYZ & UpdateRBXYZ Add sitesym …
(edit) @4613   12 months vondreele fix Origin selection wo atom selection bug in OnAssignRB
(edit) @4612   12 months vondreele change 'Process' to 'Update'
(edit) @4610   12 months vondreele change column headiings in OnRBAssign table from 'phase...' to …
(edit) @4608   12 months vondreele split VectorRB listings up into separate views for each RB in both …
(edit) @4605   12 months toby fix AddRB with no matchTable
(edit) @4602   12 months vondreele add molecular (RB) center option
(edit) @4601   12 months toby message to replace add RB table
(edit) @4600   12 months toby remove adding atoms warning; fix body fitting bugs
(edit) @4599   12 months toby remove RB match box when no atoms can be matched
(edit) @4598   12 months vondreele cosmetic changes
(edit) @4597   12 months toby add x+y and x+y+z as RB axes; move widget storage
(edit) @4595   12 months toby add RB sym axis; implement in RB add; minor RB GUI reorg
(edit) @4594   12 months vondreele remove WACV,wx.ALIGN_CENTER_VERTICAL from all Add for wx.VERTICAL …
(edit) @4583   13 months toby revise graphics & input for Insert Rigid Body
(edit) @4573   13 months toby RB extensions and minor bug fixes
(edit) @4570   13 months vondreele Implement arc mask method for determining polarization with scipy …
(edit) @4568   13 months vondreele cleanup of RollMap? command
(edit) @4564   14 months vondreele add Roll Map capability to Map Peaks menu - only for charge flip maps
(edit) @4563   14 months vondreele fix off-by-one error in Map Peaks Invert Map Peaks operation; NB: …
(edit) @4561   14 months vondreele invoke scrooling set for atom editing
(edit) @4559   14 months vondreele fix OnTransform? - the ending block of code needed to be tabbed out one …
(edit) @4558   14 months vondreele include vacancies in atom-atom table of bond limits - needed by RMCProfile
(edit) @4556   14 months vondreele Change color of As from "blue" to "orange". Implement a sampling …
(edit) @4553   14 months vondreele reimplement new PeaksUnique? code & make more general. Now finds unique …
(edit) @4551   14 months toby fix name wipe out bug
(edit) @4550   14 months vondreele use AddToNotebook? for Fourier map creation
(edit) @4547   14 months vondreele AddToNotebook? routine added & implemented for peakfit & charge flipping
(edit) @4532   15 months toby refactor ViewLSparms; more fullrmc work
(edit) @4525   15 months toby add reload to draw atoms
(edit) @4524   15 months toby rigid bodies: error on duplicate name; update draw atoms after adding …
(edit) @4523   15 months toby more fullrmc work, but not done
(edit) @4518   15 months toby start on fullrmc update for 5.0; fix for rigid bodies
(edit) @4513   16 months vondreele fix problem after setting 1-->2 transformation. A block of code …
(edit) @4508   16 months vondreele fix the select tab menu list in phases
(edit) @4507   16 months vondreele alow plotting of non integer HKL planes make planes partially …
(edit) @4505   16 months toby more fixes to Res RB edit; tweak RB atom assignment displays
(edit) @4504   16 months toby restore error for deleting RB atoms
(edit) @4503   16 months toby fix problems wit multiple instances of a single RB and with adding …
(edit) @4502   16 months vondreele Eliminate the Hatom radius & moved Bond search factor to be under Bond …
(edit) @4501   16 months vondreele move void plotting to be before slice plotting so that voids behind …
(edit) @4500   16 months toby Add sphere of atoms arround view point; show distances to peaks and …
(edit) @4499   16 months toby Add sphere of atoms arround view point; show distances to peaks and …
(edit) @4494   16 months vondreele make voids permanent,add show options for map & voids, draw voids as …
(edit) @4493   16 months vondreele strip valences from atoms in RMCProfile & fullrmc - both are blind to …
(edit) @4492   16 months vondreele cleanup here & there
(edit) @4491   16 months toby Add VoidMap?; change min/max in ValidatedTextCtrl? to xmin/xmax; new …
(edit) @4489   16 months vondreele further fixup of incommensurate mag moment drawings. Now correct.
(edit) @4487   16 months toby abort on Complete Molecule optional; bypass decode error
(edit) @4484   16 months vondreele fix setting RB thermal to 'None' replace call to …
(edit) @4479   16 months toby changes to unique map peaks & plotting after selection
(edit) @4476   17 months vondreele make sure if Uij = None that it is zero, type is 'I' and that after a …
(edit) @4473   17 months toby allow adding of rigid body atoms to atoms list
(edit) @4471   17 months vondreele restore FillCoordSphere? from G2 version #4379
(edit) @4470   17 months vondreele Add option to fade by 50% symmetry equivalent atoms, bonds, etc. in …
(edit) @4468   17 months toby add status msg on Shift-Click atom selection; error message with RB …
(edit) @4464   17 months vondreele reinstate the old FindCoordination? as FindCoordination2 - was used in …
(edit) @4462   17 months vondreele fix bug for not installed RMCProfile
(edit) @4461   17 months vondreele fix bugs in MakeRMC6f & MakefullrmcPDB
(edit) @4460   17 months vondreele correct plots for RMCProfile & fullrmc S(Q) & G(R) plots.
(edit) @4455   17 months toby fix and speed up the "Complete Molecule" command; w/o for mult calc bug
(edit) @4454   17 months vondreele allow selection by atom name (same as by type)
(edit) @4453   17 months vondreele cleanup fixes to G2pshGUI
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