|
|
@4635
|
5 years |
vondreele |
change all 'Ur' to 'r' in open commands
double all '\' in G2scriptable …
|
|
|
@4594
|
5 years |
vondreele |
remove WACV,wx.ALIGN_CENTER_VERTICAL from all Add for wx.VERTICAL …
|
|
|
@4426
|
5 years |
vondreele |
fix bug in bond restraint import
|
|
|
@4076
|
6 years |
vondreele |
fix axes amnesia for PDF plots
add plotting of P(R) pair distribution …
|
|
|
@4019
|
6 years |
vondreele |
put directions for delete restraints in status bar; fix bug in G2spc
|
|
|
@3856
|
6 years |
vondreele |
small mods to GUI for general restraints
|
|
|
@3826
|
6 years |
vondreele |
fix future problem with wx.NewId? --> wx.NewIdRef?
|
|
|
@3802
|
6 years |
toby |
generalized restraints completed
|
|
|
@3780
|
6 years |
toby |
fix typos; error in CIF Dij reporting; improve generalized restraint GUI
|
|
|
@3772
|
6 years |
toby |
add GUI (seen in debug mode only) for general (equation specified) …
|
|
|
@3682
|
7 years |
vondreele |
eliminate auto refresh og General after looking at spin ops
implement …
|
|
|
@3588
|
7 years |
vondreele |
fix old style wx.CHANGE_DIR to wx.DR_CHANGE_DIR in several places.
fix …
|
|
|
@3511
|
7 years |
vondreele |
more fixes to cell transform stuff
remove commented out code from …
|
|
|
@3427
|
7 years |
toby |
fix minor bugs
|
|
|
@3390
|
7 years |
vondreele |
fix issue with deleted phases in Restraints - they are now deleted …
|
|
|
@3356
|
7 years |
vondreele |
remove commented out SetTitle? & SetLabel? for data window from various …
|
|
|
@3355
|
7 years |
toby |
name main & plot window against project name, remove other SetTitle? calls
|
|
|
@3318
|
7 years |
vondreele |
fix problem with GenAtm? - now has spin flip in result.
|
|
|
@3243
|
7 years |
vondreele |
G2ctrlGUI: comment about PyGridTableBase? - python 3?
move VALIDPROTEIN …
|
|
|
@3239
|
7 years |
vondreele |
implement use of 2-site disordered amino acid residues in proteins: …
|
|
|
@3137
|
8 years |
vondreele |
replace old CifFile? with new py 2/7/3.6 compliant code
fix cif file …
|
|
|
@3136
|
8 years |
vondreele |
make GSAS-II python 3.6 compliant & preserve python 2.7 use;changes: …
|
|
|
@3000
|
8 years |
toby |
make the two frame version the trunk as we hit version 3000
|
|
|
@2840
|
8 years |
vondreele |
fix PDB importer & reimport atoms
rework RB GUI - now shows just one …
|
|
|
@2704
|
8 years |
vondreele |
allow chemical restraints on one or more atoms (used to be 3 or more)
|
|
|
@2702
|
8 years |
vondreele |
fix bug in G2restrGUI
|
|
|
@2569
|
8 years |
vondreele |
add 'f' or 'g' to maxdigits in FormatValue? in G2py3 - should be …
|
|
|
@2546
|
9 years |
vondreele |
cleanup of all GSASII main routines - remove unused variables, dead …
|
|
|
@2530
|
9 years |
vondreele |
finish window placement rules - data display window upper right is …
|
|
|
@2512
|
9 years |
vondreele |
remove 'constraint' and 'restraint' from Consraints & Restraints tabs …
|
|
|
@2487
|
9 years |
vondreele |
fix unit cell search range for bond distance & angle restraints
fix …
|
|
|
@2431
|
9 years |
vondreele |
fix problem with wxPython 3.x with changing text entry focus. Needed a …
|
|
|
@2343
|
9 years |
toby |
cleanups on Restraints editing
|
|
|
@1988
|
10 years |
vondreele |
fix atom id problem in AddRestraints?
refactor Modulation & …
|
|
|
@1831
|
10 years |
toby |
move remaining generic controls to G2ctrls
|
|
|
@1638
|
10 years |
vondreele |
remove status bar from restraint pages. Wasn't used & failed for …
|
|
|
@1615
|
10 years |
vondreele |
more work on incommensurate wave input to LS
fix FillAtomLookup? …
|
|
|
@1214
|
11 years |
toby |
fix use of RB vars in G2VarObj, etc.; Add select tab to restraints
|
|
|
@1103
|
12 years |
vondreele |
fixes to protein restraints & rigid body GUI issues
|
|
|
@1099
|
12 years |
vondreele |
improvements to torsion & Ramachandran plot routines
|
|
|
@1097
|
12 years |
vondreele |
mods to restraint GUI & LS output for restraints
correct torsion & …
|
|
|
@1077
|
12 years |
toby |
cleanup plot & svn bugs; set missing keywords; CIF export done; update docs
|
|
|
@923
|
12 years |
toby |
more doc updates
|
|
|
@919
|
12 years |
vondreele |
typo
|
|
|
@918
|
12 years |
vondreele |
add delt/sig column in some restraint tables
change testDeriv file name
|
|
|
@906
|
12 years |
toby |
switch to aui.notebook for data display window; work on phase data …
|
|
|
@904
|
12 years |
toby |
fix line endings
|
|
|
@863
|
12 years |
vondreele |
fix to notebook & comment (not allowed) editing
avoid a dead window …
|
|
|
@848
|
12 years |
vondreele |
move all class stuff in GSAIIphsGUI to GSASIIgrid.py
move all DData …
|
|
|
@825
|
12 years |
vondreele |
small fixes to restraint processing
|
|
|
@823
|
12 years |
vondreele |
begin Rigid Body GUI stuff - make tree entry & main GUI
GUI code is in …
|
|
|
@822
|
12 years |
vondreele |
restraints for bond, angle, plane & chiral volume complete
chem. comp. …
|
|
|
@820
|
12 years |
vondreele |
restraints development - almost done
works for bonds, angles, planes & …
|
|
|
@819
|
12 years |
vondreele |
restraint fixes
|
|
|
@818
|
12 years |
vondreele |
complete restraint GUI stuff
provide restraint plots for torsions & …
|
|
|
@817
|
12 years |
vondreele |
new GSASIIdata.py for useful data
add ramachandran calcs
show unit …
|
|
|
@815
|
12 years |
vondreele |
another hot key
more restraint development
|
|
|
@814
|
12 years |
vondreele |
implement hot keys for some main menu & menu items
fix crash in …
|
|
|
@813
|
12 years |
vondreele |
a bit more restraint fix
|
|
|
@812
|
12 years |
vondreele |
add restraint macro files
fix a triclinic error in genHlaue
continue …
|
|
|
@811
|
12 years |
vondreele |
split GSASIIgrid.py into 3 parts; GSASIIconstrGUI.py & …
|