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@2027
|
8 years |
toby |
duplicate sphinx files for ReadTheDocs? trial
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@2026
|
8 years |
toby |
autoint minimal, but ready for testing; fixes to Exports
|
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@2025
|
8 years |
vondreele |
|
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@2024
|
8 years |
vondreele |
dmin in indexing of unit cells is now taken directly from the powder …
|
|
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@2023
|
8 years |
vondreele |
fix zero sig problem in iparm calibration
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|
|
@2022
|
8 years |
vondreele |
fixes to TOF powder indexing & incommensurate structures
|
|
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@2021
|
8 years |
toby |
prevent reread of previously-read files by reading through all IMG …
|
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@2020
|
8 years |
toby |
after work w/Andrey
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|
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@2019
|
8 years |
toby |
put autoint into debug mode
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|
@2018
|
8 years |
toby |
fix export bugs; prevent exception if Cancel is used when locating a …
|
|
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@2017
|
8 years |
toby |
update reload after refinement to make sure old Id is removed; also …
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|
|
@2016
|
8 years |
toby |
force zoom out on clicking any image tree click
|
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|
@2015
|
8 years |
toby |
redo image read to avoid reloads; prevent open of Edit image parms on …
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|
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@2014
|
8 years |
vondreele |
remove Phi from Modulation & ModulationDerv? args. Not needed
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@2013
|
8 years |
vondreele |
remove two stray debug prints
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|
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@2012
|
8 years |
toby |
belated check in
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|
|
@2011
|
8 years |
vondreele |
fix image transpose error in ReadImageData?
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|
|
@2010
|
8 years |
toby |
update docs
|
|
|
@2009
|
8 years |
vondreele |
remove 4Dfourier menu from Wave Data page (best done from General …
|
|
|
@2008
|
8 years |
vondreele |
add R-values to HKL % 3D HKL plot status lines
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|
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@2007
|
8 years |
toby |
64bit mac build on BHT3 (10.6) using …
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|
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@2006
|
8 years |
vondreele |
minor work on SS structure factors
|
|
|
@2005
|
8 years |
vondreele |
add print every 100 refl. in structurefactorderv routines
fix atom loc …
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|
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@2004
|
8 years |
vondreele |
SS derivative work
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|
|
@2003
|
8 years |
toby |
Make Transpose a config opt; new routine to read images with import …
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|
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@2002
|
8 years |
toby |
fix 1st import image 1st bug
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|
|
@2001
|
8 years |
toby |
add initial Image imports code
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|
|
@2000
|
8 years |
vondreele |
fix structure factor & derivatives for single crystal & twins
fix …
|
|
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@1999
|
8 years |
vondreele |
|
|
|
@1998
|
8 years |
toby |
rebuild docs
|
|
|
@1997
|
8 years |
toby |
Add API for direct image read (G2IO.ExportPowderList?) and powder …
|
|
|
@1996
|
8 years |
vondreele |
fix Fade problem
ModulationDeriv? work
twin sf error fixed
|
|
|
@1995
|
8 years |
vondreele |
fix SS atom plotting problem
SS map scale issue
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|
|
@1994
|
8 years |
toby |
additions to test Andrey's Auto Image Integration
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|
|
@1993
|
8 years |
vondreele |
numerical derivatives for x modulations - work but slow
show density …
|
|
|
@1992
|
8 years |
vondreele |
fix SS position derivative error
|
|
|
@1991
|
8 years |
vondreele |
fix 3D plot zone p/n key problem
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|
|
@1990
|
8 years |
vondreele |
Structure factor derivs for SS continued…
|
|
|
@1989
|
8 years |
toby |
fix ValidatedTxtCtrl? bug; add option to G2CheckBox
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|
|
@1988
|
8 years |
vondreele |
fix atom id problem in AddRestraints?
refactor Modulation & …
|
|
|
@1987
|
8 years |
vondreele |
set up wave derivatives
|
|
|
@1986
|
8 years |
vondreele |
OpenGL.GLE doesn't seem to work - only used for proteins
fix …
|
|
|
@1985
|
8 years |
toby |
fix CIF import where ? is used for Uiso value and where iso/aniso type …
|
|
|
@1984
|
8 years |
vondreele |
some SS derv work
|
|
|
@1983
|
8 years |
vondreele |
fix '+' selection in PWDR plots
|
|
|
@1982
|
8 years |
vondreele |
add messages to cif import fail to identify atoms
|
|
|
@1981
|
8 years |
vondreele |
fixes to modulation plots & 3D & 4D Fourier map processing
|
|
|
@1980
|
8 years |
vondreele |
refBlk=100 version of SStructureFactor - works
|
|
|
@1979
|
8 years |
vondreele |
fix to SS structure factor now works
start SSderiv & block hkl processing
|
|
|
@1978
|
8 years |
vondreele |
fix to update reflections in HKLplot
remove ZigZag? from incommensurate …
|
|
|
@1977
|
8 years |
vondreele |
More modulation structure factor stuff, begin SSF derivatives
|
|
|
@1976
|
8 years |
vondreele |
fix bug in plotting 3D HKLs
SS str. Fctr. mods - add site fraction & …
|
|
|
@1975
|
8 years |
toby |
Address unit test problem with MoveToUnitCell?
|
|
|
@1974
|
8 years |
vondreele |
good step in ss structure factor clc.
|
|
|
@1973
|
8 years |
vondreele |
fix plot error after refine; GetPatternTreeItemId? returned zero If so …
|
|
|
@1972
|
8 years |
toby |
Element selection workaround for wx>2.8 on mac
|
|
|
@1971
|
8 years |
toby |
Add preferences option to edit configuration options
|
|
|
@1970
|
8 years |
vondreele |
Add pygauleg to pypowder.for - recompile Win2.7 & Win2.7-64
work on SS …
|
|
|
@1969
|
8 years |
vondreele |
3Dhkl plots fixed - zone plots & full allow 'P' & 'N' steps on origin
|
|
|
@1968
|
8 years |
vondreele |
3D axes now right way around
|
|
|
@1967
|
8 years |
vondreele |
fix zone view rotations of 3D hkls
|
|
|
@1966
|
8 years |
vondreele |
new 3D HKL plot commands for selecting view axes & set a zone plot - …
|
|
|
@1965
|
8 years |
toby |
was broken for sure when GSAS-II in /Program Files/... (etc.); …
|
|
|
@1964
|
8 years |
vondreele |
fix bug in atomadd for SS structures
make sure ComboBoxes? are READONLY …
|
|
|
@1963
|
8 years |
vondreele |
fix wx 3.x issue with ComboBox? & nonstandard SSpace group symbols
|
|
|
@1962
|
8 years |
vondreele |
made PackageVersions? a list so it comes out in same order as the other …
|
|
|
@1961
|
8 years |
toby |
save package info in GPX; display only in Debug mode
|
|
|
@1960
|
8 years |
toby |
add current version number to Controls dict on save; display on read
|
|
|
@1959
|
8 years |
toby |
fix crash with anaconda on Mac; allow for 2.7.xx version numbers
|
|
|
@1958
|
8 years |
vondreele |
add r-values by SS index
add a fade for frac modulation of atoms in …
|
|
|
@1957
|
8 years |
vondreele |
work on SS structure factors
some refactoring of SS special pos code …
|
|
|
@1956
|
8 years |
vondreele |
fix (again) fill unit cell, dynamic SS drawing & GenAtom? issues - now …
|
|
|
@1955
|
8 years |
vondreele |
Add error message for TOF calibration if peak positions weren't fitted …
|
|
|
@1954
|
8 years |
vondreele |
add print line whwn lambda is changed in Levenberg-Marquardt …
|
|
|
@1953
|
8 years |
vondreele |
code simplification in FillUnitCell? & MoveToUnitCell?
fix error in GenAtom?
|
|
|
@1952
|
8 years |
vondreele |
Add modulation of thermal parameters to drawing
|
|
|
@1951
|
8 years |
vondreele |
implement drawing of incommensurate structures - live variation wrt …
|
|
|
@1950
|
8 years |
vondreele |
more work on SS special pos.
|
|
|
@1949
|
8 years |
vondreele |
add image read for Rigaku R-Axis IV files
|
|
|
@1948
|
8 years |
vondreele |
modify SS special position code
|
|
|
@1947
|
8 years |
vondreele |
do export of pole figures & inverse pole figures as csv files (can be …
|
|
|
@1946
|
8 years |
vondreele |
|
|
|
@1945
|
8 years |
vondreele |
fix another new histo in new phase error
some cleanup in texture …
|
|
|
@1944
|
8 years |
vondreele |
add G2HistDataDialog for editing e.g. orientation angles over all …
|
|
|
@1943
|
8 years |
vondreele |
remove H-atom riding constraint editing; unusable at present
|
|
|
@1942
|
8 years |
vondreele |
delete unused files
|
|
|
@1941
|
8 years |
vondreele |
|
|
|
@1940
|
8 years |
vondreele |
use atom types in H-atom add; cleanup HydId? dict when H-atoms deleted
|
|
|
@1939
|
8 years |
vondreele |
change atom naming conventions - remove '()' and H atoms are numbered …
|
|
|
@1938
|
8 years |
vondreele |
H atoms now inserted into Atom list after their attchment (C, N or O)
|
|
|
@1937
|
8 years |
vondreele |
revised sucrose charge flip tutorial
|
|
|
@1936
|
8 years |
vondreele |
Add a printed "score" for unique peaks determination
Add "2-theta" to …
|
|
|
@1935
|
8 years |
vondreele |
apply Uiso (equiv) for H-atom generation/update
revise H-atom addition …
|
|
|
@1934
|
8 years |
vondreele |
fix on self.HKL error
|
|
|
@1933
|
8 years |
vondreele |
remove old reflection style patches in G2phsGUI & G2plot
fix hkl & …
|
|
|
@1932
|
8 years |
vondreele |
fix problems with plotting & phase handling when there is no structure …
|
|
|
@1931
|
8 years |
vondreele |
Autoupdate of atom drawing table and drawing after LS refinement and …
|
|
|
@1930
|
8 years |
vondreele |
allow exclude atoms from H-atom position calcs.
hydrogen add …
|
|
|
@1929
|
8 years |
vondreele |
fix sign error in getRho 8-pt interpolation
|
|
|
@1928
|
8 years |
vondreele |
fix error in Fourier calc.
new getRho routine
new add OH hydrogens …
|
|
|