source: trunk

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Diff Rev Age Author Log Message
(edit) @4421   20 months toby add R.B. extractor; misc doc updates; plt bug after strip Hs; grid …
(edit) @4420   21 months vondreele improvements to fullrmc interface
(edit) @4419   21 months toby Allow plotting to show selected atoms; reorder some code to put …
(edit) @4418   21 months vondreele change macromolecular default drawing from sticks (slow) to van der …
(edit) @4417   21 months vondreele further enhancements of the fullrmc - GSAS-II interface; now does atom …
(edit) @4416   21 months vondreele fix 3D surface problem when changing mystrain/size axis remove …
(edit) @4415   21 months vondreele change export_PDB to handle fullrmc pdb files implement Wenqian's mod …
(edit) @4413   21 months toby add texture docs and fix build problem
(edit) @4412   21 months toby update tree item display after delete data tree entry
(edit) @4411   21 months toby bug in CIF export; misc cleanup
(edit) @4410   21 months toby do much more cleanup after phase delete; refactor some importer …
(edit) @4409   21 months toby select bank for scripting simulation
(edit) @4408   21 months toby warning for MPL 3.1 & 3.2
(edit) @4406   21 months toby don't allow used PWDR or HKLF histograms to be deleted
(edit) @4405   21 months vondreele continue fullrmc interface work fix bad PatternId? problem in Texture GUI
(edit) @4404   21 months vondreele revise RMCProfile/fullrmc GUI for data files - better interface & has …
(edit) @4403   21 months toby add new incid. beam mono convolutor to FPA; refactor FPA GUI
(edit) @4402   22 months toby add scattering factors to CIF; catch overwrite of 1st reflection bug(\!\!)
(edit) @4401   22 months vondreele Add texture index & esd to texture results - all 3 different cases. …
(edit) @4400   22 months vondreele add rigid body save to make new pdb file with properly named atoms - …
(edit) @4399   22 months toby major refactoring & corrections to ISODISTORT mode import and computations
(edit) @4398   22 months vondreele fix abc* transform for layers
(edit) @4397   22 months vondreele fullrmc interface for run & view done (for now)
(edit) @4396   22 months toby improve end-of-life message, add tools to run bash/bat scripts outside …
(edit) @4389   22 months vondreele adding fullrmc View & Execute methods. Still to do Setup. Replace …
(edit) @4388   22 months vondreele Add warning for using type=2 TOF instrument profile function in old …
(edit) @4381   22 months toby update tutorial listing
(edit) @4380   22 months toby avoid missing _reverse_cmap_spec in MPL 3.2
(edit) @4379   22 months toby fix isodistort constraint processing
(edit) @4378   22 months vondreele begin fullrmc implementation - 1st avoid crash if not installed - give …
(edit) @4377   22 months vondreele Add end-of-life warning for python 2.7 small fix for mag str. fctr calc
(edit) @4375   22 months vondreele try to rationalize plot & data window behavior - put data window on …
(edit) @4374   22 months toby use https before http
(edit) @4373   22 months vondreele cleanup magnetic sym op display - now allows print of X1,x2,x3,x4 as …
(edit) @4372   22 months toby streamline Post access to web pages; try http before https
(edit) @4371   23 months vondreele patch to avoid crash on missing Layer Disp in Refine
(edit) @4370   23 months vondreele Add new parameter to Data tab - Layer DispSizerThis? is intended to …
(edit) @4369   23 months vondreele new menu item in main menu Data/Delete? plots - allows deleting …
(edit) @4368   23 months vondreele missed a III --> IV tutorial
(edit) @4366   23 months vondreele Add plotting of bond distance & bond angle distributions found in …
(edit) @4365   23 months toby set keywords & eol on all G2 files
(edit) @4364   23 months toby minor docs changes; remove remaining .xor. reference
(edit) @4363   23 months toby remove debug line
(edit) @4362   23 months toby doc stuff
(edit) @4361   23 months toby fix hist CIF export, remove dev. ver of IntPDFtool
(edit) @4360   23 months toby change load-gpx dialog to match exit and start new project
(edit) @4356   23 months vondreele remove arrowhead for quiver plot in PlotXYZvect - wasn't the right color.
(edit) @4355   23 months vondreele Add RMCProfile-III tutorial to list in G2ctrlGUI so it shows up in …
(edit) @4353   23 months toby fix bond distance monitor in sequential fit
(edit) @4352   23 months toby expand proxy GUI for more lines
(edit) @4351   23 months vondreele Work on Compare results for more than one type of bond polyhedra. Now …
(edit) @4350   23 months toby add warning for azimuths with no pixels
(edit) @4349   23 months toby fix integration over azimuths with no pixels
(edit) @4348   23 months vondreele Detail work on various RMC plots - getting titles & axes labels correct
(edit) @4347   23 months vondreele restrict G(R) plots to Rmax - sphere enclosed by big box model in …
(edit) @4346   23 months toby implement additional proxy access (documented in …
(edit) @4345   23 months toby Add more image settings to preferences; prevent save of …
(edit) @4344   23 months vondreele
(edit) @4343   23 months toby deal with exporters sharing extension in autointegration
(edit) @4342   23 months vondreele correct scale factor for xray .bragg file try 1/w for xray real space …
(edit) @4341   23 months vondreele use size & mustrain correctly in making RMCProfile .inst file
(edit) @4340   23 months vondreele change http to https for Bilbao web side - works better via eduroam, etc.
(edit) @4339   23 months toby set svn flags; improve compare F-test & add info & covariance plot
(edit) @4338   23 months vondreele fix bug in integrate when no spot mask default set up.
(edit) @4337   23 months vondreele add 'Va' for vacancy to valence table skip 'Va' atoms in partials …
(edit) @4336   23 months toby new docs section
(edit) @4335   23 months toby add autoInt routine, add f-test; updates for documentation
(edit) @4334   23 months vondreele make new f(q) & g(r) files suitable for RMCProfile. The g(r) == PDF. …
(edit) @4333   23 months vondreele work on spot masking; change some text, menu names, etc. Add menu item …
(edit) @4332   2 years vondreele faster build of spot mask spot masks now work in integrate all
(edit) @4330   2 years vondreele Added RMCProfile-II to list of tutorials fix a crash problem in …
(edit) @4328   2 years vondreele Add FITTED_SCALE to RMCprofile options fix issues with changing atom …
(edit) @4327   2 years toby misc doc updates
(edit) @4326   2 years toby initialize exports before histogram export
(edit) @4325   2 years vondreele small RMCProfile fixes New auto spot mask version - works
(edit) @4324   2 years vondreele revised auto spot finder; set default esdMul = 3 everywhere try …
(edit) @4323   2 years vondreele fixes to ave & fixed CN constraint for RMCProfile
(edit) @4322   2 years vondreele fic Compare plots; some overwritten by mistake
(edit) @4321   2 years vondreele correct G(R) partials for atom fraction & scattering length
(edit) @4320   2 years toby still more minor doc adjustments
(edit) @4319   2 years toby remove plot debug code
(edit) @4318   2 years toby minor table adjustments & finally figure out Angstrom for LaTeX and …
(edit) @4317   2 years vondreele make esd multiplier for spot mask search a float add timing to it
(edit) @4316   2 years vondreele slight streamline of AutoSpotMask2 - a bit faster
(edit) @4315   2 years vondreele more fixes to documentation tables.
(edit) @4314   2 years vondreele
(edit) @4313   2 years toby giving up, LaTeX Angstrom symbol does not work in equations
(edit) @4312   2 years toby Fix LaTeX Angstrom symbol for MathJaX again
(edit) @4311   2 years toby Fix LaTeX Angstrom symbol for MathJaX
(edit) @4310   2 years toby remove Angstrom symbol. MathJaX fix fails in LaTeX
(edit) @4309   2 years toby more work on docs
(edit) @4308   2 years vondreele revisions to docs - set columns at tabs, fix up Instrument parms
(edit) @4307   2 years toby pretty up docs
(edit) @4306   2 years vondreele major doc edits
(edit) @4305   2 years toby improve docs
(edit) @4304   2 years toby add sample broadening to scriptable
(edit) @4303   2 years toby fix scriptable for multiple image files and xfer correction in @4286
(edit) @4302   2 years vondreele full implementation of the new spotmask finder.
(edit) @4301   2 years toby initialize SpotMask? for image import
(edit) @4300   2 years toby fix problem with missing SpotMask? entry
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