|
|
@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
|
|
|
@4514
|
3 years |
vondreele |
remove non gpx entries from recent projects
continue work on magnetism
|
|
|
@4513
|
3 years |
vondreele |
fix problem after setting 1-->2 transformation. A block of code …
|
|
|
@4512
|
3 years |
vondreele |
fix to tif image importer
|
|
|
@4511
|
3 years |
toby |
fix rename, make sure hist is not used
|
|
|
@4510
|
3 years |
vondreele |
fix magnetic site sym bug
|
|
|
@4509
|
3 years |
vondreele |
fix texture refinement error - incorrect azimuth values
|
|
|
@4508
|
3 years |
vondreele |
fix the select tab menu list in phases
|
|
|
@4507
|
3 years |
vondreele |
alow plotting of non integer HKL planes
make planes partially …
|
|
|
@4506
|
3 years |
toby |
update pdbparser pkg
|
|
|
@4505
|
3 years |
toby |
more fixes to Res RB edit; tweak RB atom assignment displays
|
|
|
@4504
|
3 years |
toby |
restore error for deleting RB atoms
|
|
|
@4503
|
3 years |
toby |
fix problems wit multiple instances of a single RB and with adding …
|
|
|
@4502
|
3 years |
vondreele |
Eliminate the Hatom radius & moved Bond search factor to be under Bond …
|
|
|
@4501
|
3 years |
vondreele |
move void plotting to be before slice plotting so that voids behind …
|
|
|
@4500
|
3 years |
toby |
Add sphere of atoms arround view point; show distances to peaks and …
|
|
|
@4499
|
3 years |
toby |
Add sphere of atoms arround view point; show distances to peaks and …
|
|
|
@4498
|
3 years |
toby |
cleanup errors and cruft noted in spyder
|
|
|
@4497
|
3 years |
toby |
pkg new versions of fullrmc support packages
|
|
|
@4496
|
3 years |
toby |
pkg new versions of fullrmc support packages
|
|
|
@4495
|
3 years |
vondreele |
Improve lighting for unit cell box & view point cross
|
|
|
@4494
|
3 years |
vondreele |
make voids permanent,add show options for map & voids, draw voids as …
|
|
|
@4493
|
3 years |
vondreele |
strip valences from atoms in RMCProfile & fullrmc - both are blind to …
|
|
|
@4492
|
3 years |
vondreele |
cleanup here & there
|
|
|
@4491
|
3 years |
toby |
Add VoidMap?; change min/max in ValidatedTextCtrl? to xmin/xmax; new …
|
|
|
@4490
|
3 years |
vondreele |
replace all single value TextCtrl? with ValidatedTextCtrl?; remove thus …
|
|
|
@4489
|
3 years |
vondreele |
further fixup of incommensurate mag moment drawings. Now correct.
|
|
|
@4488
|
3 years |
vondreele |
another try at incommensurate magnetic SF; fix bug in plotting mag moments.
|
|
|
@4487
|
3 years |
toby |
abort on Complete Molecule optional; bypass decode error
|
|
|
@4486
|
3 years |
vondreele |
fix status bar atom label problem when picking atoms from drawing
|
|
|
@4485
|
3 years |
vondreele |
fix plotting of BNS centered modulated magnetic moment plotting
|
|
|
@4484
|
3 years |
vondreele |
fix setting RB thermal to 'None'
replace call to …
|
|
|
@4483
|
3 years |
vondreele |
fix to MagMod? /2 error
fix bug in HKLF reflection list
|
|
|
@4482
|
3 years |
toby |
2nd mpl.cm.ScalarMappable?() fix
|
|
|
@4481
|
3 years |
vondreele |
Fix appearance of FileDialog? in GetImportFile? - CenterOnParent?() …
|
|
|
@4480
|
3 years |
toby |
fix colormap problem w/3.0.x
|
|
|
@4479
|
3 years |
toby |
changes to unique map peaks & plotting after selection
|
|
|
@4478
|
3 years |
toby |
update new version of g2conda: 3.7+, mpl 3.0 only
|
|
|
@4477
|
3 years |
toby |
update new version of g2conda: 3.7+, mpl 3.0 or 3.3; sync up …
|
|
|
@4476
|
3 years |
vondreele |
make sure if Uij = None that it is zero, type is 'I' and that after a …
|
|
|
@4475
|
3 years |
vondreele |
fix prolem in cif files where anisotropic params are as ...... --> …
|
|
|
@4474
|
3 years |
vondreele |
fix minor cif problem - order of "source" and "neutron"
|
|
|
@4473
|
3 years |
toby |
allow adding of rigid body atoms to atoms list
|
|
|
@4472
|
3 years |
toby |
remove hardcoded libgcc_s.1.dylib from Mac binaries
|
|
|
@4471
|
3 years |
vondreele |
restore FillCoordSphere? from G2 version #4379
|
|
|
@4470
|
3 years |
vondreele |
Add option to fade by 50% symmetry equivalent atoms, bonds, etc. in …
|
|
|
@4469
|
3 years |
toby |
fix for TOF simulation scripting; improve peak selection status line …
|
|
|
@4468
|
3 years |
toby |
add status msg on Shift-Click atom selection; error message with RB …
|
|
|
@4467
|
3 years |
vondreele |
fix map peak selection
|
|
|
@4466
|
3 years |
vondreele |
change Pawley refinement menu items for setting/unsetting refine flags …
|
|
|
@4465
|
3 years |
vondreele |
fix atom selection from figure for Atoms - now it the same as for Draw …
|
|
|
@4464
|
3 years |
vondreele |
reinstate the old FindCoordination? as FindCoordination2 - was used in …
|
|
|
@4463
|
3 years |
toby |
Redisplay structure after a shift-click to select an atom; update plot …
|
|
|
@4462
|
3 years |
vondreele |
fix bug for not installed RMCProfile
|
|
|
@4461
|
3 years |
vondreele |
fix bugs in MakeRMC6f & MakefullrmcPDB
|
|
|
@4460
|
3 years |
vondreele |
correct plots for RMCProfile & fullrmc S(Q) & G(R) plots.
|
|
|
@4459
|
3 years |
vondreele |
Add missing pictures to Magnetic-V tutorial
|
|
|
@4458
|
3 years |
vondreele |
add missing pictures for TOF single crystal refinement tutorial
|
|
|
@4457
|
3 years |
toby |
add data link to tutorials
|
|
|
@4456
|
3 years |
vondreele |
fix bug in SytSym?
|
|
|
@4455
|
3 years |
toby |
fix and speed up the "Complete Molecule" command; w/o for mult calc bug
|
|
|
@4454
|
3 years |
vondreele |
allow selection by atom name (same as by type)
|
|
|
@4453
|
3 years |
vondreele |
cleanup fixes to G2pshGUI
|
|
|
@4452
|
3 years |
toby |
test data link
|
|
|
@4451
|
3 years |
vondreele |
Add Histogram distances & angles to Phase/Atom/Compute? menu
fix …
|
|
|
@4450
|
3 years |
vondreele |
Add Histogram bonds & angles to Atoms/Compute? menu - makes histogram …
|
|
|
@4449
|
3 years |
vondreele |
fix atom pick routine in structure drawing
|
|
|
@4448
|
3 years |
toby |
add complete molecule (slow) & fix use of radii
|
|
|
@4447
|
3 years |
vondreele |
change RMCProfie chi2 to log10 chi2 to match fulrmc chi2 plot
fix …
|
|
|
@4446
|
3 years |
toby |
final fixes of bootstrap
|
|
|
@4445
|
3 years |
toby |
more tests of packaging
|
|
|
@4444
|
3 years |
toby |
test breaking packaging?\!
|
|
|
@4443
|
3 years |
toby |
try more to fix packaging bug
|
|
|
@4442
|
3 years |
toby |
better atom selection; try to fix packaging bug
|
|
|
@4441
|
3 years |
vondreele |
cleanup of GenAtom?
fix Dist Angle calcs for an imported phase with no …
|
|
|
@4440
|
3 years |
vondreele |
fix atom draw update problem when atoms not in unit cell2Arelated …
|
|
|
@4439
|
3 years |
toby |
bootstrap w/selected binary; update svn switch cmd; save build output
|
|
|
@4438
|
3 years |
svnjenkins |
Build with Build_Mac_py3.7 on mac mac-1
|
|
|
@4437
|
3 years |
toby |
add fix for paths in libraries
|
|
|