source: trunk/GSASIIconstrGUI.py

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Diff Rev Age Author Log Message
(edit) @5070   4 years toby ISO: add show mode defs; create CIF for ISO calc; remove ISO calc from …
(edit) @5067   4 years toby ISODISTORT mode/displacement fixes; allow indexing of all Phases where …
(edit) @5065   4 years vondreele remove check on Histograms & Phases in beginning of UpdateConstraints? …
(edit) @5058   4 years vondreele provide sliders for mode displacements - not connected yet
(edit) @5057   4 years vondreele cleanup ISODISTORT references in constraints & its phase tab …
(edit) @5043   4 years vondreele Add ISODISTORT menu option to RMC menu; active only for PDFfit (under …
(edit) @5040   4 years toby fix sym-gen constraint display
(edit) @5038   4 years toby Major revision to constraints including an update to the Sequential …
(edit) @5002   4 years vondreele allow constraints between like Debye & Bragg peak parameters.
(edit) @4998   4 years toby partial fix of magnetic constraints (still need to deal w/unvaried …
(edit) @4983   4 years toby fix initialization problem when EQUIV are changed to constraints; …
(edit) @4982   4 years toby fix check on non-zero multipliers
(edit) @4980   4 years toby Fix coeff. display for EQUIV
(edit) @4907   4 years vondreele use eigenvalue/vector math to find molecule orientation in onSetPlane
(edit) @4906   4 years vondreele
(edit) @4905   4 years toby fix delete for general; flag constraints where vars are removed
(edit) @4851   4 years toby reformat equivalence pairs as Bob prefers
(edit) @4849   4 years toby apply symmetry constraints on rigid body origin; show position vars …
(edit) @4838   4 years vondreele comment out MakeDrawAtom? in G2constrGUI & make the call to …
(edit) @4823   4 years toby fix naming of new variable constraints; label them & improve …
(edit) @4822   4 years toby Warn if param limits on constrained vars
(edit) @4812   4 years vondreele Add Cycle XYZ button on residue RB GUI & add description to help text …
(edit) @4809   4 years toby display more Residue rigid body info; better docs
(edit) @4805   4 years toby start replacing dataWindow.GetSizer? with .SetSizer? since Sizer could …
(edit) @4782   4 years toby scripting fix; wx4.1 RB fixes
(edit) @4672   5 years vondreele remove all wx.ALIGN from wx Add with wx.EXPAND - invalid combination …
(edit) @4635   5 years vondreele change all 'Ur' to 'r' in open commands double all '\' in G2scriptable …
(edit) @4624   5 years toby improve rigid body stuff; finish tutorial
(edit) @4615   5 years toby Add DrawAtoms_default config option to set default drawing type; add …
(edit) @4609   5 years vondreele name the Vector RB atoms. Don't appear in RB table but do show when …
(edit) @4608   5 years vondreele split VectorRB listings up into separate views for each RB in both …
(edit) @4606   5 years vondreele revise Orientation reference help text for Vector & Residue RBs
(edit) @4605   5 years toby fix AddRB with no matchTable
(edit) @4604   5 years toby add help to Orientation reference controls; improve helpbutton formatting
(edit) @4603   5 years vondreele change CheckBox? to Button for use RB center
(edit) @4602   5 years vondreele add molecular (RB) center option
(edit) @4594   5 years vondreele remove WACV,wx.ALIGN_CENTER_VERTICAL from all Add for wx.VERTICAL …
(edit) @4584   5 years toby prevent duplicate names for rigid bodies; make sure vector RB has 3+ …
(edit) @4577   5 years vondreele A much better fix to the C++ bug. Happens in Windows when gpx file …
(edit) @4576   5 years vondreele fix C++ crash in GSASIIconstrGUI.py - 2 OnPageChanged? routines cor …
(edit) @4573   5 years toby RB extensions and minor bug fixes
(edit) @4505   5 years toby more fixes to Res RB edit; tweak RB atom assignment displays
(edit) @4503   5 years toby fix problems wit multiple instances of a single RB and with adding …
(edit) @4492   5 years vondreele cleanup here & there
(edit) @4455   5 years toby fix and speed up the "Complete Molecule" command; w/o for mult calc bug
(edit) @4431   5 years toby new code for locating RBs; redo GUI for RB extractor
(edit) @4421   5 years toby add R.B. extractor; misc doc updates; plt bug after strip Hs; grid …
(edit) @4400   5 years vondreele add rigid body save to make new pdb file with properly named atoms - …
(edit) @4399   5 years toby major refactoring & corrections to ISODISTORT mode import and computations
(edit) @4379   5 years toby fix isodistort constraint processing
(edit) @4270   5 years vondreele set default directories to G2frame.LastGPXdir or result from …
(edit) @4041   6 years vondreele fix issues with rigid body GUI controls - mostly proper assignment of rbId
(edit) @4020   6 years vondreele comment out sell constraint build for transform & mag structures - …
(edit) @3948   6 years vondreele a better way to fix scroll bar issue in Residue RB display
(edit) @3947   6 years vondreele fix to Residue RB scroll issue with residue selection; had to resize …
(edit) @3944   6 years toby fix for vector rigid body display
(edit) @3943   6 years vondreele fix scroll bars in Residue rigid body display
(edit) @3905   6 years vondreele fix to atom constraints from structure transform
(edit) @3904   6 years vondreele fix lattice parm constraint bug
(edit) @3835   6 years vondreele Allow constraints on modulation vector changes to incommensurate mag. …
(edit) @3829   6 years vondreele fix problem with selecting torsions in residue rigid bodies
(edit) @3791   6 years toby cleanup constraint display more
(edit) @3790   6 years toby make sure off-diagonal terms that must compute as 0 are fixed
(edit) @3789   6 years toby fix transpose error for lattice constraints
(edit) @3788   6 years toby generate cell parm constraints for magnetic cells; fix errors in …
(edit) @3785   6 years toby generate lattice constraints for mag. xform
(edit) @3784   6 years toby generate lattice constraints for mag. xform
(edit) @3760   7 years vondreele remove AwaveType?,PwaveType?,FwaveType? & MwaveType? from constraints …
(edit) @3735   7 years vondreele oops got monoclinic A3 & A5 switched!
(edit) @3734   7 years vondreele fix to SetUniqAj? - inside TransConstraints?
(edit) @3721   7 years vondreele put in (now commented out) new code for making lattice constraints for …
(edit) @3717   7 years vondreele comment all lines for making lattice constraint
(edit) @3716   7 years vondreele implement new version of SUBGROUPS & k-SUBGROUPDMAG that return …
(edit) @3711   7 years toby major constraint update: move conflicting equivs to constraints; allow …
(edit) @3703   7 years vondreele refactoring of GetSSfxuinel
(edit) @3699   7 years vondreele make check for duplicate constraints (via strings) in TransConstraints? …
(edit) @3693   7 years vondreele magAtoms --> magAtms spelling error n RefreshMagCellsGrid? allow …
(edit) @3691   7 years vondreele fix constraints on transformed lattice parameters to preserve higher …
(edit) @3649   7 years toby Change display of equivalences
(edit) @3647   7 years toby do removal of vars when window is created
(edit) @3618   7 years vondreele comment out creation of Uij constraints for new mag phases - not …
(edit) @3617   7 years vondreele fix mag space group counts fix k-SUBGROUPSMAG k-vec input fix lattice …
(edit) @3601   7 years vondreele fix a weird wx4.0 C++ error in G2constrGUI (line 2212)
(edit) @3599   7 years toby remove vars from constraints (see G2obj.removeNonRefined); new tutorial
(edit) @3588   7 years vondreele fix old style wx.CHANGE_DIR to wx.DR_CHANGE_DIR in several places. fix …
(edit) @3577   7 years vondreele delete MAXMAGN - not using it any more fix (maybe) mag constraints; …
(edit) @3567   7 years vondreele fix wx.wx bug in G2constrGUI better formatting of Platform: line on …
(edit) @3510   7 years svnjenkins CheckScalePhaseFractions?: use only on PWDR hists
(edit) @3507   7 years svnjenkins bug fixes: checking phase frac constraint, when histograms not in a …
(edit) @3470   7 years vondreele add a comeent/question for OnConstDel? (no effect on processing) …
(edit) @3468   7 years vondreele define new function FindAllCons? to replace bits of identical code that …
(edit) @3467   7 years vondreele fix problem in constraints where a deleted constraint variable wasn't …
(edit) @3462   7 years toby move check of fractions/scale to OnRefine? and OnView?
(edit) @3456   7 years vondreele change delete constraint code
(edit) @3438   7 years vondreele g2strIO fix magnetic hkl extinctions in reflection generation remove …
(edit) @3413   7 years vondreele modify RefineCore? & Refine/SeqRefine? to use ifSeq parameter instead of …
(edit) @3411   7 years vondreele another transform constrint fix to atom nos.
(edit) @3410   7 years vondreele bad Uij names fixed in Transform constraints
(edit) @3409   7 years vondreele another fix to transformation constraints to skip equivalent …
(edit) @3406   7 years vondreele fix Transform to create correct(?) constraints between lattices, atom …
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