|
|
@4618
|
3 years |
vondreele |
Update RB atom site frac when origin of RB is shifted from one …
|
|
|
@4617
|
3 years |
vondreele |
removed 'backbone' as a possible macromolecular plot default - doesn't work
|
|
|
@4616
|
3 years |
vondreele |
fix a bunch of escape sequence '\' to ' ' in G2obj
Add display of …
|
|
|
@4615
|
3 years |
toby |
Add DrawAtoms_default config option to set default drawing type; add …
|
|
|
@4614
|
3 years |
vondreele |
provide protection for acosd in RotateRBXYZ & UpdateRBXYZ
Add sitesym …
|
|
|
@4613
|
3 years |
vondreele |
fix Origin selection wo atom selection bug in OnAssignRB
|
|
|
@4612
|
3 years |
vondreele |
change 'Process' to 'Update'
|
|
|
@4611
|
3 years |
vondreele |
fix RB atom names for either vector and residue RBs
|
|
|
@4610
|
3 years |
vondreele |
change column headiings in OnRBAssign table from 'phase...' to …
|
|
|
@4609
|
3 years |
vondreele |
name the Vector RB atoms. Don't appear in RB table but do show when …
|
|
|
@4608
|
3 years |
vondreele |
split VectorRB listings up into separate views for each RB in both …
|
|
|
@4607
|
3 years |
toby |
make patch create missing entries
|
|
|
@4606
|
3 years |
vondreele |
revise Orientation reference help text for Vector & Residue RBs
|
|
|
@4605
|
3 years |
toby |
fix AddRB with no matchTable
|
|
|
@4604
|
3 years |
toby |
add help to Orientation reference controls; improve helpbutton formatting
|
|
|
@4603
|
3 years |
vondreele |
change CheckBox? to Button for use RB center
|
|
|
@4602
|
3 years |
vondreele |
add molecular (RB) center option
|
|
|
@4601
|
3 years |
toby |
message to replace add RB table
|
|
|
@4600
|
3 years |
toby |
remove adding atoms warning; fix body fitting bugs
|
|
|
@4599
|
3 years |
toby |
remove RB match box when no atoms can be matched
|
|
|
@4598
|
3 years |
vondreele |
cosmetic changes
|
|
|
@4597
|
3 years |
toby |
add x+y and x+y+z as RB axes; move widget storage
|
|
|
@4596
|
3 years |
vondreele |
another python 3.4+ fix
|
|
|
@4595
|
3 years |
toby |
add RB sym axis; implement in RB add; minor RB GUI reorg
|
|
|
@4594
|
3 years |
vondreele |
remove WACV,wx.ALIGN_CENTER_VERTICAL from all Add for wx.VERTICAL …
|
|
|
@4593
|
3 years |
vondreele |
fix image plotting issues with 2-theta limits, arc & ring masks & …
|
|
|
@4592
|
3 years |
vondreele |
fix crash in CalcPDF where the profile W array was 1 longer than the …
|
|
|
@4591
|
3 years |
toby |
fix limit bug
|
|
|
@4590
|
3 years |
toby |
complete scripting for Parameter Limits
|
|
|
@4589
|
3 years |
vondreele |
new GetDetectorXY routine to return correct xy positions for arcs, …
|
|
|
@4588
|
3 years |
toby |
use G2VarObj for param limits; add more info to seq. ref. done dialog; …
|
|
|
@4587
|
3 years |
vondreele |
New version of GetTthAzmDsp? to use det2theta
|
|
|
@4586
|
3 years |
vondreele |
fix the new GetTthAzmG
|
|
|
@4585
|
3 years |
vondreele |
use new GetTthAzmG version for image integrations.
|
|
|
@4584
|
3 years |
toby |
prevent duplicate names for rigid bodies; make sure vector RB has 3+ …
|
|
|
@4583
|
3 years |
toby |
revise graphics & input for Insert Rigid Body
|
|
|
@4582
|
3 years |
vondreele |
New image calibration/integration routines for 2-theta stepped …
|
|
|
@4581
|
3 years |
toby |
magnetism bugs: Load Phase not reseting SGData; error msg when somehow …
|
|
|
@4579
|
3 years |
toby |
bug fix: mising Uiso from parameter list
|
|
|
@4578
|
3 years |
toby |
docs for freezing parameters started + docs cleanup; start scriptable …
|
|
|
@4577
|
3 years |
vondreele |
A much better fix to the C++ bug. Happens in Windows when gpx file …
|
|
|
@4576
|
3 years |
vondreele |
fix C++ crash in GSASIIconstrGUI.py - 2 OnPageChanged? routines cor …
|
|
|
@4573
|
3 years |
toby |
RB extensions and minor bug fixes
|
|
|
@4572
|
3 years |
vondreele |
Further enhancements to polarization analysis - now automatic & makes …
|
|
|
@4571
|
3 years |
vondreele |
Improvements to polarization stuff
|
|
|
@4570
|
3 years |
vondreele |
Implement arc mask method for determining polarization with scipy …
|
|
|
@4569
|
3 years |
vondreele |
cleanup a debug in image calibrate
|
|
|
@4568
|
3 years |
vondreele |
cleanup of RollMap? command
|
|
|
@4567
|
3 years |
toby |
improve excluded region generation
|
|
|
@4566
|
3 years |
toby |
improve excluded region generation
|
|
|
@4565
|
3 years |
vondreele |
fix mpl 3.03 error message
shift XY2 colors by one in PlotXY - avoids …
|
|
|
@4564
|
3 years |
vondreele |
add Roll Map capability to Map Peaks menu - only for charge flip maps
|
|
|
@4563
|
3 years |
vondreele |
fix off-by-one error in Map Peaks Invert Map Peaks operation; NB: …
|
|
|
@4562
|
3 years |
vondreele |
remove extra equivalent positions from dist/angle list - needed %1. in …
|
|
|
@4561
|
3 years |
vondreele |
invoke scrooling set for atom editing
|
|
|
@4560
|
3 years |
vondreele |
fix *.10 error in XScattDen - used in reflectometry & small angle …
|
|
|
@4559
|
3 years |
vondreele |
fix OnTransform? - the ending block of code needed to be tabbed out one …
|
|
|
@4558
|
3 years |
vondreele |
include vacancies in atom-atom table of bond limits - needed by RMCProfile
|
|
|
@4557
|
3 years |
vondreele |
fix math error in StructureFactorDeriv? - sym op matrix needed …
|
|
|
@4556
|
3 years |
vondreele |
Change color of As from "blue" to "orange".
Implement a sampling …
|
|
|
@4554
|
3 years |
vondreele |
remove CR from Notebook entries
|
|
|
@4553
|
3 years |
vondreele |
reimplement new PeaksUnique? code & make more general. Now finds unique …
|
|
|
@4552
|
3 years |
vondreele |
reinstate wx.CallAfter? for ReloadFromGPX - needed to get reload to …
|
|
|
@4551
|
3 years |
toby |
fix name wipe out bug
|
|
|
@4550
|
3 years |
vondreele |
use AddToNotebook? for Fourier map creation
|
|
|
@4549
|
3 years |
vondreele |
use AddToNotebook? in Refine - remove wx.CallAfter? for self.ReloadFrom? …
|
|
|
@4548
|
3 years |
vondreele |
Add csv exporter for reflectometry data
|
|
|
@4547
|
3 years |
vondreele |
AddToNotebook? routine added & implemented for peakfit & charge flipping
|
|
|
@4546
|
3 years |
vondreele |
correct ring intensities for polarization in IntStrSta?
fill missing …
|
|
|
@4545
|
3 years |
vondreele |
fix IntStrSta? to return list not zip
|
|
|
@4544
|
3 years |
vondreele |
add the other ToolBarDraw?
|
|
|
@4543
|
3 years |
vondreele |
test change G2plot for mpl 3.3
|
|
|
@4542
|
3 years |
vondreele |
revert PeaksUniqure? back to version <#4473 so it properly does sorted …
|
|
|
@4541
|
3 years |
vondreele |
minor fixes to PDF plotting
|
|
|
@4540
|
3 years |
vondreele |
another fix to Instrument Parameters plot for pink peaks
remove …
|
|
|
@4539
|
3 years |
vondreele |
remove commented old/bad code in G2IO
fix Instrument parameters plots …
|
|
|
@4538
|
3 years |
vondreele |
fix integer divide issue in ComputeArc? in G2plot
remove Spotmask is …
|
|
|
@4537
|
3 years |
vondreele |
comment out 'Spotmask missing' message
remove aspect='equal' from a …
|
|
|
@4536
|
3 years |
vondreele |
supply missing default pink derivatives
fix "Bravais lattice" issues …
|
|
|
@4535
|
3 years |
vondreele |
fix X-label for pink powder patterns
revert incomm. mag. str. factor …
|
|
|
@4534
|
3 years |
toby |
implement variable limits; show cell under Dij vals
|
|
|
@4533
|
3 years |
vondreele |
fix math error in incomm mag str fctr stuff $ expand equations
|
|
|
@4532
|
3 years |
toby |
refactor ViewLSparms; more fullrmc work
|
|
|
@4531
|
3 years |
vondreele |
remove q-plot & d-plot options for Limits PWDR plot
some cleanup in …
|
|
|
@4530
|
3 years |
toby |
guess at clearly erroneous line for grace output
|
|
|
@4529
|
3 years |
toby |
add show option to publish plot
|
|
|
@4528
|
3 years |
vondreele |
change "if 'mag' ..." to "if 'magline' ..." in various places in …
|
|
|
@4527
|
3 years |
toby |
limits bug in hist.EditSimulated?; add default for do_refinements(); …
|
|
|
@4526
|
3 years |
vondreele |
fix to incomm. moment display
|
|
|
@4525
|
3 years |
toby |
add reload to draw atoms
|
|
|
@4524
|
3 years |
toby |
rigid bodies: error on duplicate name; update draw atoms after adding …
|
|
|
@4523
|
3 years |
toby |
more fullrmc work, but not done
|
|
|
@4522
|
3 years |
vondreele |
fix exporters for pink reflection data
|
|
|
@4521
|
3 years |
vondreele |
complete pink Rietveld refinement
fix problem with weights
enhance …
|
|
|
@4520
|
3 years |
vondreele |
some corrections for pink beam single peak fits
implement pink beam …
|
|
|
@4519
|
3 years |
vondreele |
G2fpaGUI - minor cleanup
G2lattice - test on 'T' instead of 'C' so …
|
|
|
@4518
|
3 years |
toby |
start on fullrmc update for 5.0; fix for rigid bodies
|
|
|
@4517
|
3 years |
toby |
doc build issues
|
|
|
@4516
|
3 years |
toby |
doc build problem
|
|
|
@4515
|
3 years |
toby |
new capability: general parameter access
|
|
|