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source: trunk/expgui @ 12

Last change on this file since 12 was 12, checked in by toby, 14 years ago
# on 1998/12/28 02:33:30, toby did: minor fixes comment out $expgui(lsFrame).f1.a.cbXXX entries until Bob gets the new version out
Property rcs:author set to `toby` Property rcs:date set to `1998/12/28 02:33:30` Property rcs:lines set to `+16 -9` Property rcs:rev set to `1.2` Property rcs:state set to `Exp` Property svn:keywords set to `Author Date Revision Id`
File size: 95.7 KB

Line
1	#!/usr/local/bin/wish
2	set expgui(Revision) {$Revision: 12 $ $Date: 2009-12-04 22:58:53 +0000 (Fri, 04 Dec 2009) $}
3
4	# to do:
5	#
6	# global background editing & profile work differently: should both
7	# start out blank with a "load from option"?
8	#
9	# menu for least squares options
10	# idea:
11	# a scroll list for all histogram refinement flags ; click on takes you to the
12	# appropriate menu.
13	#
14	# to allow global access on phase page
15	# change buttons from radio to multiple
16	# -- or display all 9 cell flag/damps and all atoms
17	# make editMultipleRecords work with multiple phases, also cell flag/damp
18	# blank cell entries
19	# add phase to atom number in listing
20	# DisplayAllAtoms needs to loop over phases: expgui(curPhase)
21
22	if {$argv != ""} {
23	set expfile [lindex $argv 0]
24	if {[string toupper [file extension $expfile]] != ".EXP"} {
25	append expfile ".EXP"
26	}
27	} else {
28	# windows needs this update or focus gets screwed up after tk_getOpenFile
29	update
30	set expfile [tk_getOpenFile -defaultextension .EXP \
31	-filetypes {{"GSAS Experiment" ".EXP"}} -parent .]
32	}
33	if {$expfile == ""} exit
34	if ![file exists $expfile] {
35	tk_dialog .expFileErrorMsg "File Open Error" \
36	"File $expfile does not exist" error 0 "Exit"
37	exit
38	}
39
40	set expgui(debug) 0
41	catch {if $env(DEBUG) {set expgui(debug) 1}}
42	#set expgui(debug) 1
43
44	set expgui(havetix) 1
45	# for debugging non-Tix version set environment variable NOTIX
46	catch {if $env(NOTIX) {set expgui(havetix) 0}}
47	if $expgui(havetix) {
48	if [catch {package require Tix}] {set expgui(havetix) 0}
49	}
50	# default is archive = on
51	set expgui(archive) 1
52	#----------------------------------------------------------------
53	# where are we?
54	set expgui(script) [info script]
55	# translate links -- go six levels deep
56	foreach i {1 2 3 4 5 6} {
57	if {[file type $expgui(script)] == "link"} {
58	set link [file readlink $expgui(script)]
59	if { [file pathtype $link] == "absolute" } {
60	h set expgui(script) $link
61	} {
62	set expgui(script) [file dirname $expgui(script)]/$link
63	}
64	} else {
65	break
66	}
67	}
68	set expgui(scriptdir) [file dirname $expgui(script) ]
69	#----------------------------------------------------------------
70	# fetch EXP routines
71	source [file join $expgui(scriptdir) readexp.tcl]
72
73	# constants
74	set expgui(coordfont) "--courier-bold-r-normal--12-"
75	set expgui(histfont) "--courier-bold-r-normal--12-"
76
77	#=============================================================================
78	# Store names of profile terms.
79	array set expgui {
80	prof-T-1 {TOF-type1 alp-0 bet-0 sig-0 alp-1 bet-1 sig-1 rstr rsta \
81	sig-2 rsca s1ec s2ec }
82	prof-T-2 {TOF-type2 alp-0 sig-0 gam-0 alp-1 sig-1 gam-1 beta sig-2 \
83	gam-2 switch ptec stec difc difa zero }
84	prof-T-3 {TOF-type3 alp bet-0 bet-1 sig-0 sig-1 sig-2 gam-0 gam-1 \
85	gam-2 gsf g1ec g2ec rstr rsta rsca L11 L22 L33 L12 L13 L23 }
86	prof-T-4 {TOF-type4 alp bet-0 bet-1 sig-1 sig-2 gam-2 g2ec gsf \
87	rstr rsta rsca eta}
88	prof-C-1 {CW-type U V W asym F1 F2 }
89	prof-C-2 {CW-type2 GU GV GW LX LY trns asym shft GP stec ptec sfec \
90	L11 L22 L33 L12 L13 L23 }
91	prof-C-3 {CW-type3 GU GV GW GP LX LY S/L H/L trns shft stec ptec sfec \
92	L11 L22 L33 L12 L13 L23 }
93	prof-C-4 {CW-type4 GU GV GW GP LX ptec trns shft sfec S/L H/L eta}
94	}
95	# >>>>>>>>>>>>>>>> End of Profile Terms >>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>
96	#
97	# >>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>
98	# <<<<<<<<<< BEGINNING OF MAIN: GLOBAL AREA FOR DATA EXTRACTION >>>>>>>>>>>
99	# >>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>
100	# load exp file and set up dialogs
101	proc loadexp {expfile} {
102	global expgui expmap entryvar entrycmd
103	global exparray
104	catch {
105	unset exparray
106	unset expmap
107	}
108	expload $expfile
109	set expgui(changed) 0
110	mapexp
111
112	# set the window/icon title
113	wm title . $expfile
114	wm iconname . [file tail $expfile]
115
116	set expgui(curPhase) ""
117	# set the number of phases on the phase page
118	setphases
119
120	set expgui(pagenow) ""
121
122	# update the histogram list
123	sethistlist
124
125	if !$expgui(havetix) {
126	RaisePage phaseFrame
127	} else {
128	.n raise phasePane
129	set expgui(pagenow) phaseFrame
130	}
131	# select the 1st phase
132	SelectOnePhase [lindex $expmap(phaselist) 0]
133	# disable the "global options" that don't make sense
134	foreach num {1 2 3 4 5} {
135	set flag($num) 0
136	}
137	foreach h $expmap(powderlist) {
138	if {[string range $expmap(htype_$h) 2 2] == "T"} {set flag(1) 1}
139	if {[string range $expmap(htype_$h) 1 2] == "NC"} {set flag(2) 1}
140	if {[string range $expmap(htype_$h) 1 2] == "XC" && \
141	[histinfo $h lam2] != 0.0} {set flag(3) 1}
142	if {[string range $expmap(htype_$h) 1 2] == "XC" && \
143	[histinfo $h lam2] == 0.0} {set flag(4) 1}
144	if {[string range $expmap(htype_$h) 1 2] == "XE"} {set flag(5) 1}
145	}
146	foreach num {1 2 3 4 5} \
147	lbl {TOF "CW Neutron" "Alpha12 Xray" "Monochromatic Xray" \
148	"Energy Disp Xray"} {
149	if $flag($num) {
150	$expgui(fm).edit.menu entryconfigure $lbl -state normal
151	} else {
152	$expgui(fm).edit.menu entryconfigure $lbl -state disabled
153	}
154	}
155	# disable traces on entryvar until we are ready
156	set entrycmd(trace) 0
157
158	# least squares page
159	set entryvar(cycles) [expinfo cycles]
160	set entrycmd(cycles) "expinfo cycles"
161	set expgui(globalmode) 0
162	set expgui(printopt) "Print Options ([expinfo print])"
163	global printopts
164	foreach num [array names printopts] {
165	set entrycmd(printopt$num) "printsetting $num"
166	set entryvar(printopt$num) [printsetting $num]
167	}
168	# enable traces on entryvar
169	set entrycmd(trace) 1
170	}
171
172	# called to reread the .EXP file -- use after another program
173	# has changed the experiment file
174	proc rereadexp {expfile} {
175	global expgui
176	if $expgui(changed) {
177	set decision [tk_dialog .instrSaveData {Save .EXP changes} \
178	{You have made changes to the Experiment. Rereading will cause the changes to be lost. Select an option:} \
179	{} 0 "Save and reread" "Reread without Save" "Cancel reread command"]
180	switch $decision {
181	0 { archiveexp $expfile }
182	1 { }
183	2 { return }
184	}
185	}
186	loadexp $expfile
187	}
188
189	proc SaveAsFile {} {
190	global expfile expgui
191	set newexpfile [tk_getSaveFile -defaultextension .EXP \
192	-filetypes {{"GSAS Experiment" ".EXP"}} -parent . \
193	-initialdir [file dirname $expfile] \
194	-initialfile [file tail $expfile] ]
195	if {$newexpfile == ""} return
196	set expfile $newexpfile
197	expwrite $expfile
198	set expgui(changed) 0
199	# set the window/icon title
200	wm title . $expfile
201	wm iconname . [file tail $expfile]
202	}
203
204	# called to read a different .EXP file
205	proc readnewexp {} {
206	global expgui expfile
207	if $expgui(changed) {
208	set decision [tk_dialog .instrSaveData {Save .EXP changes} \
209	{You have made changes to the Experiment. Reading a different file will cause the changes to be lost. Select an option:} \
210	{} 0 "Save and read" "Read without Save" "Cancel read command"]
211	switch $decision {
212	0 { archiveexp $expfile }
213	1 { }
214	2 { return }
215	}
216	}
217	set newexpfile [tk_getOpenFile -defaultextension .EXP \
218	-filetypes {{"GSAS Experiment" ".EXP"}} -parent . \
219	-initialdir [file dirname $expfile] ]
220	if {$newexpfile == ""} return
221	set expfile $newexpfile
222	loadexp $expfile
223	}
224
225	#------------- set up data read/write layer ----------------------
226	# trace routine on entryvar
227	proc entvartrace {array elem action} {
228	global expgui entrycmd entryvar
229	if !$entrycmd(trace) return
230
231	catch {
232	incr expgui(changed)
233	if $expgui(debug) {puts "$entrycmd($elem) set $entryvar($elem) "}
234	if {$entrycmd($elem) == ""} return
235	if [catch {
236	eval $entrycmd($elem) set $entryvar($elem)
237	if {[lindex $entrycmd($elem) 0] == "atominfo"} {
238	after idle {DisplayAllAtoms noreset}
239	}
240	} errmsg] {puts "entvartrace error: $errmsg"}
241	}
242	}
243
244	# disable traces on entryvar until we are ready
245	set entrycmd(trace) 0
246	trace variable entryvar w entvartrace
247
248	#
249	#
250	#
251	##############################################################################
252	##### #####################################################
253	##### PROCEDURES SECTION #####################################################
254	##### #####################################################
255	##############################################################################
256	# reset routine is used for debugging
257	proc reset {} {
258	global expgui script argv expfile
259	set script $expgui(script)
260	set argv $expfile
261	# remove traces
262	global entryvar
263	foreach cmd [trace vinfo entryvar] {
264	eval trace vdelete entryvar $cmd
265	}
266	global expgui
267	foreach cmd [trace vinfo expgui(backterms)] {
268	eval trace vdelete entryvar $cmd
269	}
270	foreach cmd [trace vinfo expgui(backtype)] {
271	eval trace vdelete entryvar $cmd
272	}
273	foreach a {exparray expmap expgui entryvar entrycmd} {
274	global $a
275	catch {unset $a}
276	}
277	foreach w [winfo children .] {
278	destroy $w
279	}
280
281	uplevel #0 {source $script}
282	}
283
284	proc About { } {
285	global expgui expmap
286	tk_dialog .about {About...} \
287	"EXPGUI\n\
288	Jonathan Wasserman and Brian Toby\n\
289	NIST Center for Neutron Research\n\n\
290	1998, Not subject to copyright\n\n\
291	Revision [lindex $expgui(Revision) 1] (readexp.tcl [lindex $expmap(Revision) 1])" \
292	info 0 OK
293	}
294
295	# -------- called to confirm before exiting
296	proc catchQuit {} {
297	if {[confirmBeforeSave] == "Continue"} {
298	destroy .
299	}
300	}
301	# save the .EXP file before exiting?
302	proc confirmBeforeSave {} {
303	global expgui expfile
304	if !$expgui(changed) {
305	return "Continue"
306	}
307	set decision [tk_dialog .instrSaveData {Save .EXP changes} \
308	{You have made changes to the Experiment, but the changes are not saved. Select an option:} \
309	{} 0 "Save and Exit" "Exit without Save" "Cancel exit command"]
310	switch $decision {
311	0 { archiveexp $expfile; return "Continue" }
312	1 { return "Continue" }
313	2 { return "Cancel" }
314	}
315	}
316
317	proc archiveexp {expfile} {
318	global expgui tcl_platform
319	if !$expgui(changed) return
320	if $expgui(archive) {
321	catch {
322	set expnam [file rootname $expfile]
323	if {$tcl_platform(platform) == "windows"} {
324	if ![file executable [file join $expgui(scriptdir) pkzip.exe]] {
325	# archive w/o pkzip
326	set files [glob -nocomplain ${expnam}!*.exp]
327	if {$files == ""} {
328	set num -1
329	} else {
330	set file [lindex [lsort -decreasing $files] 0]
331	regexp {!([0-9]+)\.EXP} [string toupper $file] a num
332	}
333	set file $expnam![format "%3.3d" [incr num]].EXP
334	file copy $expnam.EXP $file
335	set fp [open $expnam.lst a]
336	puts $fp "\n--------------------------------------------------------------"
337	puts $fp "Archiving $expnam.EXP as $file"
338	puts $fp "--------------------------------------------------------------\n"
339	close $fp
340	} else {
341	# archive with PKZIP
342	# need to limit expnam to 8 characters
343	set sexp [string toupper [string range [file root [file tail $expnam] ] 0 7]]
344	# PKZIP can't handle long dir names either
345	cd [set dir [file dirname $expnam]]
346	set num -1
347	# get the versions from the listing
348	if [file exists $sexp.zip] {
349	set fp [open "\| [file join $expgui(scriptdir) pkzip.exe] -vb $sexp" r]
350	while {[gets $fp line] >= 0} {
351	regexp "$sexp\.0?0?(\[0-9\]+)" [string toupper $line] junk n
352	catch {if {$n > $num} {set num $n}}
353	}
354	close $fp
355	}
356	incr num
357	set file $sexp.[format "%3.3d" $num]
358	file copy -force $expnam.EXP $file
359	exec [file join $expgui(scriptdir) pkzip.exe] -m $expnam $file > x.x &
360	set fp [open $expnam.lst a]
361	puts $fp "\n--------------------------------------------------------------"
362	puts $fp "Archiving $expnam.EXP as $file in [file join $dir $sexp.ZIP]"
363	puts $fp "--------------------------------------------------------------\n"
364	close $fp
365	}
366	} else {
367	set files [glob -nocomplain $expnam.EXP.*]
368	if {$files == ""} {
369	set file $expnam.EXP.000
370	} else {
371	set file [lindex [lsort -decreasing $files] 0]
372	regexp {.\.EXP.0?0?([0-9]).*} $file junk number
373	incr number
374	set file $expnam.EXP.[format "%3.3d" $number]
375	}
376	exec cp $expfile $file
377	if [catch {exec gzip $file}] {
378	exec echo "\n----------------------------------------------" >> $expnam.LST
379	exec echo " Archiving $expnam.EXP as $file " >> $expnam.LST
380	exec echo "----------------------------------------------\n" >> $expnam.LST
381	} else {
382	exec echo "\n----------------------------------------------" >> $expnam.LST
383	exec echo " Archiving $expnam.EXP as $file.gz " >> $expnam.LST
384	exec echo "----------------------------------------------\n" >> $expnam.LST
385	}
386	}
387	} errmsg
388	if {$errmsg != ""} {
389	tk_dialog .warn Confirm "Error in archive: $errmsg" warning 0 OK
390	}
391	}
392	# now save the file
393	expwrite $expfile
394	}
395
396	# set the number of phases on the phase page
397	proc setphases {} {
398	global expgui expmap
399	eval destroy [pack slaves $expgui(phaseFrame).top.ps]
400	foreach num $expmap(phaselist) {
401	pack [button $expgui(phaseFrame).top.ps.$num -text $num \
402	-command "SelectOnePhase $num"] -side left
403	}
404	# set the default data to be the first phase and the first histogram
405	set expgui(lasthist) [lindex $expmap(powderlist) 0]
406	}
407
408	# Procedure to respond to changes the phase.
409	# This loads the "phases" widgets with data corresponding to the selected phase.
410	proc SelectOnePhase {num} {
411	global entryvar entrycmd expmap expgui
412	foreach n $expmap(phaselist) {
413	if {$n == $num} {
414	$expgui(phaseFrame).top.ps.$num config -relief sunken
415	} else {
416	$expgui(phaseFrame).top.ps.$n config -relief raised
417	}
418	}
419	set crsPhase $num
420	if {$crsPhase == ""} return
421	set expgui(curPhase) $crsPhase
422	# we have a phase
423
424	# disable traces on entryvar for right now
425	set entrycmd(trace) 0
426
427	##########################################################
428	###### SECTION: ASSIGNMENT OF DATA VARIABLES ##########
429	##########################################################
430	# phase title
431	set entrycmd(phasename) {}
432	set entryvar(phasename) [phaseinfo $crsPhase name]
433	# cell parameters & flags
434	foreach ent {a b c alpha beta gamma cellref celldamp} {
435	set entrycmd($ent) "phaseinfo $crsPhase $ent"
436	set entryvar($ent) [phaseinfo $crsPhase $ent]
437	}
438
439	#Procedure call: DisplayU -- Display Anisotropic/Isotropic widget or disable
440	# initialize to diasbled
441	DisplayAtom 0 0
442	DisplayU 0 0
443	DisplayRefFlags 0 0
444	$expgui(EditingAtoms) config -text ""
445
446	DisplayAllAtoms
447
448	# enable traces on entryvar now
449	set entrycmd(trace) 1
450	}
451
452	set expgui(noreenterDisplayAllAtoms) 0
453	# Populate expgui(atomlistbox) (ScrolledListBox) with atoms from selected phase.
454	proc DisplayAllAtoms {"mode reset"} {
455	global entryvar entrycmd expmap expgui
456	# if it does not show, dont bother
457	if {$expgui(pagenow) != "phaseFrame"} return
458	if {$expgui(curPhase) == ""} return
459	if $expgui(noreenterDisplayAllAtoms) return
460
461	set expgui(noreenterDisplayAllAtoms) 1
462	if {$mode != "reset"} {
463	set selectlist [$expgui(atomlistbox) curselection]
464	set pos [lindex [$expgui(atomlistbox) yview] 0]
465	}
466	$expgui(atomlistbox) delete 0 end
467	# loop over atoms
468	set maxline I
469	set phase $expgui(curPhase)
470	set atomlist {}
471	if {$expgui(asorttype) == "type"} {
472	# sort on atom type
473	foreach atom $expmap(atomlist_$phase) {
474	lappend atomlist "$atom [atominfo $phase $atom type] $phase"
475	}
476	set expmap(atomlistboxcontents) [lsort -ascii -index 1 $atomlist]
477	} elseif {$expgui(asorttype) == "number"} {
478	# sort on atom number
479	foreach atom $expmap(atomlist_$phase) {
480	lappend atomlist "$atom $atom $phase"
481	}
482	set expmap(atomlistboxcontents) [lsort -integer -index 1 $atomlist]
483	} elseif {$expgui(asorttype) == "x"} {
484	# sort on x
485	foreach atom $expmap(atomlist_$phase) {
486	lappend atomlist "$atom [atominfo $phase $atom x] $phase"
487	}
488	set expmap(atomlistboxcontents) [lsort -real -index 1 $atomlist]
489	} elseif {$expgui(asorttype) == "y"} {
490	# sort on y
491	foreach atom $expmap(atomlist_$phase) {
492	lappend atomlist "$atom [atominfo $phase $atom y] $phase"
493	}
494	set expmap(atomlistboxcontents) [lsort -real -index 1 $atomlist]
495	} elseif {$expgui(asorttype) == "z"} {
496	# sort on z
497	foreach atom $expmap(atomlist_$phase) {
498	lappend atomlist "$atom [atominfo $phase $atom z] $phase"
499	}
500	set expmap(atomlistboxcontents) [lsort -real -index 1 $atomlist]
501	} else {
502	error "Bad expgui(asorttype = $expgui(asorttype)"
503	}
504
505	foreach tuple $expmap(atomlistboxcontents) {
506	set atom [lindex $tuple 0]
507	set phase [lindex $tuple 2]
508	set refflag {}
509	foreach type {x u f} {
510	if {[atominfo $phase $atom ${type}ref]} {
511	append refflag "[string toupper $type][atominfo $phase $atom ${type}damp] "
512	} else {
513	append refflag " [atominfo $phase $atom ${type}damp] "
514	}
515	}
516	set line [format "%3d %-6s %-6s %8s %10.6f%10.6f%10.6f%9.4f" \
517	$atom \
518	[atominfo $phase $atom label] \
519	[atominfo $phase $atom type] \
520	$refflag \
521	[atominfo $phase $atom x] \
522	[atominfo $phase $atom y] \
523	[atominfo $phase $atom z] \
524	[atominfo $phase $atom frac]
525	]
526	# add temperature factors (iso/anoiso)
527	if {[atominfo $phase $atom temptype] == "A"} {
528	set maxline A
529	append line [format " %9.5f%9.5f%9.5f%9.5f%9.5f%9.5f" \
530	[atominfo $phase $atom U11] \
531	[atominfo $phase $atom U22] \
532	[atominfo $phase $atom U33] \
533	[atominfo $phase $atom U12] \
534	[atominfo $phase $atom U23] \
535	[atominfo $phase $atom U13]
536	]
537	} else {
538	append line [format " %9.5f" \
539	[atominfo $phase $atom Uiso]
540	]
541	}
542	$expgui(atomlistbox) insert end $line
543	}
544	$expgui(atomtitle) delete 0 end
545	if {$maxline == "A"} {
546	$expgui(atomtitle) insert end [format "%10s %6s %8s %30s%9s %s" \
547	" name " "type " "ref/damp " "fractional coordinates " \
548	" Occupancy" \
549	"Uiso/Uij "]
550	} else {
551	$expgui(atomtitle) insert end [format "%10s %6s %8s %30s%9s %s" \
552	" name " "type " "ref/damp " "fractional coordinates " \
553	" Occupancy" \
554	"Uiso"]
555	}
556	if {$mode != "reset"} {
557	foreach i $selectlist {
558	$expgui(atomlistbox) selection set $i
559	$expgui(atomlistbox) yview moveto $pos
560	}
561	}
562	set expgui(noreenterDisplayAllAtoms) 0
563	}
564
565	# Procedure to select all atoms in response to a right-click
566	proc SelectAllAtoms {} {
567	global expgui
568	$expgui(atomlistbox) selection set 0 end
569	# just in case this was called at the wrong time:
570	editRecord
571	}
572
573	# Procedure to respond to left mouse release in the atoms Pane
574	proc editRecord { args } {
575	global entrycmd expgui
576	set selectIndex [$expgui(atomlistbox) curselection]
577	# disable traces on entryvar for right now
578	set entrycmd(trace) 0
579
580	if {[llength $selectIndex] == 0} {
581	puts "How did this happen: [$expgui(atomlistbox) curselection]"
582	} elseif {[llength $selectIndex] == 1} {
583	editOneRecord $selectIndex
584	} else {
585	editMultipleRecords $selectIndex
586	}
587	# reenable traces on entryvar
588	set entrycmd(trace) 1
589	# repaint the atoms box in case anything was changed
590	# DisplayAllAtoms noreset
591	}
592
593	proc editOneRecord { AtomIndex } {
594	global expmap expgui
595	# get atom number & phase
596	set tuple [lindex $expmap(atomlistboxcontents) $AtomIndex]
597	set atomnum [lindex $tuple 0]
598	set p [lindex $tuple 2]
599	DisplayU $atomnum $p
600	DisplayAtom $atomnum $p
601	DisplayRefFlags $atomnum $p
602	$expgui(EditingAtoms) config -text "Editing atom #$atomnum -- [atominfo $p $atomnum label]"
603	}
604
605	# this will not work for a multi-phase list of atoms (yet)
606	proc editMultipleRecords { AtomIndexList } {
607	global expmap expgui
608	set numberList {}
609	# current phase
610	set p $expgui(curPhase)
611	foreach AtomIndex $AtomIndexList {
612	# get atom number & phase
613	set tuple [lindex $expmap(atomlistboxcontents) $AtomIndex]
614	lappend numberList [lindex $tuple 0]
615	# set p [lindex $tuple 2]
616	}
617	# this needs to track by phase
618	$expgui(EditingAtoms) config -text \
619	"Set refinement options: atoms [CompressList $numberList]"
620	DisplayU 0 0
621	DisplayAtom 0 0
622	# this needs to track by phase
623	DisplayRefFlags $numberList $p
624	}
625
626	# format a string of numbers to save space, e.g. "1 2 3 4 6 7 19 13 14 15"
627	# becomes "1-4,6,7,13-15,19"
628	proc CompressList {numberList} {
629	# format the number list to save space
630	set lastnum -99
631	set flist {}
632	set count 0
633	foreach num [lsort -integer $numberList] {
634	set next [expr $lastnum+1]
635	if {$num != $next} {
636	if {$count == 0 && $flist != ""} {
637	append flist ",$num"
638	} elseif {$count == 1 && $flist != ""} {
639	append flist ",$lastnum,$num"
640	} elseif {$flist != ""} {
641	append flist "-$lastnum,$num"
642	} else {
643	append flist "$num"
644	}
645	set lastnum $num
646	set count 0
647	} else {
648	incr count
649	incr lastnum
650	}
651	}
652	if {$count == 1 && $flist != ""} {
653	append flist ",$lastnum"
654	} elseif {$flist != "" && $count > 1} {
655	append flist "-$lastnum"
656	}
657	return $flist
658	}
659
660	# Procedure to display Isotropic or Anisotropic temperature factors
661	# Changes the display to one entry widget for Isotropic motion OR
662	# 6 entry widgets for Anisotropic motion in Frame3.
663	# or disables the widet entirly if atom = 0
664	proc DisplayU { atomnum p} {
665	global expgui entryvar entrycmd
666	if {$atomnum == 0} {
667	set iOrA disable
668	} else {
669	set iOrA [atominfo $p $atomnum temptype]
670	}
671
672	set firstbox [lindex $expgui(anisolabels) 0]
673	if { $iOrA == "A" } {
674	$firstbox config -text "U11 "
675	foreach item $expgui(anisolabels) {
676	$item config -fg black
677	}
678	foreach item $expgui(anisoentry) var {U11 U22 U33 U12 U13 U23} {
679	set entrycmd($var) "atominfo $p $atomnum $var"
680	set entryvar($var) [eval $entrycmd($var)]
681	$item config -fg black -state normal -bg white
682	}
683	} elseif { $iOrA == "I" \|\| $iOrA == "disable"} {
684	foreach item $expgui(anisolabels) {
685	# $item config -fg grey
686	$item config -fg beige
687	}
688	foreach item [lrange $expgui(anisoentry) 1 end] \
689	var {U22 U33 U12 U13 U23} {
690	set entrycmd($var) ""
691	set entryvar($var) ""
692	$item config -fg beige -bg beige -state disabled
693	}
694	if { $iOrA == "disable"} {
695	set entrycmd($var) ""
696	set entryvar($var) ""
697	# [lindex $expgui(anisoentry) 0] config -fg white -state disabled
698	[lindex $expgui(anisoentry) 0] config -fg beige -bg beige -state disabled
699	} else {
700	set entrycmd(U11) "atominfo $p $atomnum Uiso"
701	set entryvar(U11) [eval $entrycmd(U11)]
702	$firstbox config -text Uiso -fg black
703	[lindex $expgui(anisoentry) 0] config -fg black -bg white -state normal
704	}
705	}
706	}
707
708	# need to think about multiple phases
709
710	# Procedure to display refinement flags
711	proc DisplayRefFlags { atomnum p} {
712	global expgui entryvar entrycmd
713	if {$atomnum == 0} {
714	foreach label $expgui(atomreflbl) {
715	$label config -fg beige
716	}
717	foreach entry $expgui(atomref) {
718	$entry config -state disabled -fg beige -bg beige
719	}
720	return
721	}
722	foreach label $expgui(atomreflbl) {
723	$label config -fg black
724	}
725	foreach entry $expgui(atomref) {
726	$entry config -state normal -fg black -bg beige
727	}
728	foreach var {xref uref fref xdamp udamp fdamp} {
729	set entrycmd($var) "atominfo $p [list $atomnum] $var"
730	set entryvar($var) [eval $entrycmd($var)]
731	}
732	}
733
734	# Procedure to display an atom in the atom edit boxes
735	proc DisplayAtom { atomnum p} {
736	global expgui entryvar entrycmd
737	if {$atomnum == 0} {
738	foreach label $expgui(atomlabels) {
739	$label config -fg beige
740	}
741	foreach entry $expgui(atomentry) {
742	$entry config -state disabled -fg beige -bg beige
743	}
744	return
745	}
746	foreach label $expgui(atomlabels) {
747	$label config -fg black
748	}
749	foreach entry $expgui(atomentry) {
750	$entry config -state normal -fg black -bg white
751	}
752	foreach var {x y z label frac } {
753	set entrycmd($var) "atominfo $p $atomnum $var"
754	set entryvar($var) [eval $entrycmd($var)]
755	}
756	}
757
758	# update the histogram list
759	# to do: show histogram ref flags?
760	proc sethistlist {} {
761	global expgui expmap
762	set expgui(curhist) 0
763	foreach lbox $expgui(HistSelectList) {
764	$lbox.title delete 0 end
765	$lbox.lbox delete 0 end
766	if {$expgui(globalmode) != 0} {
767	$lbox.lbox config -selectmode extended
768	} else {
769	$lbox.lbox config -selectmode browse
770	}
771	}
772	# disable the unallowed pages in all mode
773	if {$expgui(globalmode) == 6} {
774	foreach pair $expgui(GlobalModeAllDisable) {
775	if {$expgui(pagenow) == [lindex $pair 0]} {
776	if !$expgui(havetix) {
777	RaisePage phaseFrame
778	} else {
779	.n raise phasePane
780	set expgui(pagenow) phaseFrame
781	}
782	}
783	eval [lindex $pair 1] -state disabled
784	}
785	} else {
786	foreach pair $expgui(GlobalModeAllDisable) {
787	eval [lindex $pair 1] -state normal
788	}
789	}
790	if {$expgui(hsorttype) == "type"} {
791	# sort on histogram type
792	foreach h [lsort -integer -increasing $expmap(powderlist)] {
793	lappend histlist "$h [string range $expmap(htype_$h) 1 2]"
794	}
795	set expmap(histlistboxcontents) [lsort -ascii -index 1 $histlist]
796	} elseif {$expgui(hsorttype) == "number"} {
797	# sort on histogram number
798	foreach h [lsort -integer -increasing $expmap(powderlist)] {
799	lappend histlist "$h $h"
800	}
801	set expmap(histlistboxcontents) [lsort -integer -index 1 $histlist]
802	} elseif {$expgui(hsorttype) == "bank"} {
803	# sort on original bank number
804	foreach h [lsort -integer -increasing $expmap(powderlist)] {
805	lappend histlist "$h [histinfo $h bank]"
806	}
807	set expmap(histlistboxcontents) [lsort -integer -index 1 $histlist]
808	} elseif {$expgui(hsorttype) == "angle"} {
809	# sort on wavelength (CW) or angle (E disp.)
810	foreach h [lsort -integer -increasing $expmap(powderlist)] {
811	if {[string range $expmap(htype_$h) 2 2] == "T"} {
812	set det [format %8.2f [histinfo $h tofangle]]
813	} elseif {[string range $expmap(htype_$h) 2 2] == "C"} {
814	set det [format %8.5f [histinfo $h lam1]]
815	} elseif {[string range $expmap(htype_$h) 2 2] == "E"} {
816	set det [format %8.2f [histinfo $h lam1]]
817	} else {
818	set det {}
819	}
820	lappend histlist "$h $det"
821	}
822	set expmap(histlistboxcontents) [lsort -real -index 1 $histlist]
823	}
824	# title field needs to match longest title
825	foreach lbox $expgui(HistSelectList) {
826	$lbox.title insert end [format "%2s %s %4s %8s %-67s" \
827	"h#" \
828	type \
829	bank \
830	"ang/wave" \
831	" title" \
832	]
833	}
834	foreach tuple $expmap(histlistboxcontents) {
835	set h [lindex $tuple 0]
836
837	if {$expgui(globalmode) == 1} {
838	if {[string range $expmap(htype_$h) 2 2] != "T"} continue
839	} elseif {$expgui(globalmode) == 2} {
840	if {[string range $expmap(htype_$h) 1 2] != "NC"} continue
841	} elseif {$expgui(globalmode) == 3} {
842	if {[string range $expmap(htype_$h) 1 2] != "XC" \|\| \
843	[histinfo $h lam2] == 0.0} continue
844	} elseif {$expgui(globalmode) == 4} {
845	if {[string range $expmap(htype_$h) 1 2] != "XC" \|\| \
846	[histinfo $h lam2] != 0.0} continue
847	} elseif {$expgui(globalmode) == 5} {
848	if {[string range $expmap(htype_$h) 1 2] != "XE"} continue
849	}
850
851	if {[string range $expmap(htype_$h) 2 2] == "T"} {
852	set det [format %8.2f [histinfo $h tofangle]]
853	} elseif {[string range $expmap(htype_$h) 2 2] == "C"} {
854	set det [format %8.5f [histinfo $h lam1]]
855	} elseif {[string range $expmap(htype_$h) 2 2] == "E"} {
856	set det [format %8.2f [histinfo $h lam1]]
857	} else {
858	set det {}
859	}
860	foreach lbox $expgui(HistSelectList) {
861	$lbox.lbox insert end [format "%2d %s %4d %8s %-67s" \
862	$h \
863	[string range $expmap(htype_$h) 1 2] \
864	[histinfo $h bank] \
865	$det \
866	[string range [histinfo $h title] 0 66] \
867	]
868	}
869	}
870	foreach set $expgui(frameactionlist) {
871	if {$expgui(pagenow) == [lindex $set 0]} [lindex $set 1]
872	}
873	}
874
875	#-----------------------------------------------------------------------
876	# ----------- draw Histogram page
877	#-----------------------------------------------------------------------
878	proc DisplayHistogram {} {
879	global expgui entrycmd entryvar expmap
880
881	# display the selected histograms
882	$expgui(histFrame).hs.lbox selection clear 0 end
883	foreach h $expgui(curhist) {
884	$expgui(histFrame).hs.lbox selection set $h
885	}
886
887	# disable traces on entryvar for right now
888	set entrycmd(trace) 0
889
890	# get histogram list
891	set histlist {}
892	foreach item $expgui(curhist) {
893	lappend histlist [lindex $expmap(powderlist) $item]
894	}
895	if {$expgui(globalmode) != 0} {
896	set expgui(backtermlbl) ""
897	set expgui(backtypelbl) ""
898	foreach var {scale sref sdamp bref bdamp} {
899	set entrycmd($var) "histinfo [list $histlist] $var"
900	set entryvar($var) [histinfo [lindex $histlist 0] $var]
901	}
902	} else {
903	set hist $histlist
904	set terms [histinfo $hist backterms]
905	set expgui(backtermlbl) "($terms terms)"
906	set expgui(backtypelbl) "Function type [histinfo $hist backtype]"
907	foreach var {scale sref sdamp bref bdamp} {
908	set entrycmd($var) "histinfo $hist $var"
909	set entryvar($var) [eval $entrycmd($var)]
910	}
911	}
912	# Scale factor box & Top box
913	if {$expgui(globalmode) != 0} {
914	$expgui(histFrame).top.txt config \
915	-text "Selected Histograms: [CompressList $histlist]"
916	grid $expgui(histFrame).top -column 1 -row 0 -sticky nsew
917	set parm [grid info $expgui(scaleBox).ent1]
918	if {$parm != ""} {
919	grid forget $expgui(scaleBox).ent1
920	eval grid $expgui(scaleBox).but1 $parm
921	}
922	set expgui(bkglbl) "Globally Edit Background"
923	} else {
924	grid forget $expgui(histFrame).top
925	set parm [grid info $expgui(scaleBox).but1]
926	if {$parm != ""} {
927	grid forget $expgui(scaleBox).but1
928	eval grid $expgui(scaleBox).ent1 $parm
929	}
930	set expgui(bkglbl) "Edit Background"
931	}
932
933	# diffractometer constants
934	foreach var {lam1 lam2 kratio pola ipola ddamp zero \
935	wref pref dcref daref ratref ttref zref } {
936	set entrycmd($var) "histinfo [list $histlist] $var"
937	set entryvar($var) [histinfo [lindex $histlist 0] $var]
938	}
939
940	eval destroy [grid slaves $expgui(diffBox)]
941	if {$expgui(globalmode) == 0} {
942	if {[string range $expmap(htype_$hist) 2 2] == "T"} {
943	#------
944	# TOF \|
945	#------
946	grid [ label $expgui(diffBox).lDCrc -text "Refine DIFC" ] \
947	-column 1 -row 1
948	grid [ checkbutton $expgui(diffBox).rfDCrc -variable entryvar(dcref) ] \
949	-column 2 -row 1
950	grid [ label $expgui(diffBox).lDCdifc -text DIFC ] \
951	-column 3 -row 1 -sticky w
952	grid [ entry $expgui(diffBox).eDCdifc -textvariable entryvar(lam1) \
953	-width 15 ] -column 4 -row 1
954	#
955	grid [ label $expgui(diffBox).lDCra -text "Refine DIFA" ] \
956	-column 1 -row 2
957	grid [ checkbutton $expgui(diffBox).rfDCra -variable entryvar(daref) ] \
958	-column 2 -row 2
959	grid [ label $expgui(diffBox).lDCdifa -text DIFA ] \
960	-column 3 -row 2
961	grid [ entry $expgui(diffBox).eDCdifa -textvariable entryvar(lam2) \
962	-width 15 ] -column 4 -row 2
963	#
964	grid [ label $expgui(diffBox).lDCzero -text "Zero"] \
965	-column 3 -row 3
966	grid [ entry $expgui(diffBox).eDCzero -textvariable entryvar(zero) \
967	-width 15 ] -column 4 -row 3
968	grid [ label $expgui(diffBox).lDCzref -text "Refine zero" ] \
969	-column 1 -row 3 -sticky w
970	grid [ checkbutton $expgui(diffBox).rfDCzref \
971	-variable entryvar(zref) ] -column 2 -row 3
972	} elseif {[string range $expmap(htype_$hist) 1 2] == "NC"} {
973	#---------------
974	# CW - neutron \|
975	#---------------
976	grid [ label $expgui(diffBox).lDC1 -text "Refine wave" ] \
977	-column 1 -row 1
978	grid [ checkbutton $expgui(diffBox).rfDC1 -variable entryvar(wref) ] \
979	-column 2 -row 1
980	grid [ label $expgui(diffBox).lDCdifc -text wave ] \
981	-column 3 -row 1 -sticky w
982	grid [ entry $expgui(diffBox).eDCdifc -textvariable entryvar(lam1) \
983	-width 15 ] -column 4 -row 1
984	#
985	grid [ label $expgui(diffBox).lDCzref -text "Refine zero" ] \
986	-column 1 -row 3 -sticky w
987	grid [ checkbutton $expgui(diffBox).rfDCzref \
988	-variable entryvar(zref) ] -column 2 -row 3
989	grid [ label $expgui(diffBox).lDCzero -text "Zero"] \
990	-column 3 -row 3
991	grid [ entry $expgui(diffBox).eDCzero -textvariable entryvar(zero) \
992	-width 15 ] -column 4 -row 3
993	} elseif {[string range $expmap(htype_$hist) 1 2] == "XC" && \
994	[histinfo $hist lam2] == 0.0} {
995	#--------------------------
996	# CW - x-ray 1 wavelength \|
997	#--------------------------
998	grid [ label $expgui(diffBox).lDC1 -text "Refine wave" ] \
999	-column 1 -row 1
1000	grid [ checkbutton $expgui(diffBox).rfDC1 -variable entryvar(wref) ] \
1001	-column 2 -row 1
1002	grid [ label $expgui(diffBox).lDCdifc -text wave ] \
1003	-column 3 -row 1 -sticky w
1004	grid [ entry $expgui(diffBox).eDCdifc -textvariable entryvar(lam1) \
1005	-width 15 ] -column 4 -row 1
1006	#
1007	grid [ label $expgui(diffBox).lDCzref -text "Refine zero" ] \
1008	-column 1 -row 3 -sticky w
1009	grid [ checkbutton $expgui(diffBox).rfDCzref \
1010	-variable entryvar(zref) ] -column 2 -row 3
1011	grid [ label $expgui(diffBox).lDCzero -text "Zero"] \
1012	-column 3 -row 3
1013	grid [ entry $expgui(diffBox).eDCzero -textvariable entryvar(zero) \
1014	-width 15 ] -column 4 -row 3
1015	#
1016	grid [ label $expgui(diffBox).lDCpref -text "Refine POLA" ] \
1017	-column 1 -row 4 -sticky w
1018	grid [ checkbutton $expgui(diffBox).rfDCpref \
1019	-variable entryvar(pref) ] -column 2 -row 4
1020	grid [ label $expgui(diffBox).lDCpola -text POLA ] \
1021	-column 3 -row 4
1022	grid [ entry $expgui(diffBox).eDCpola \
1023	-textvariable entryvar(pola) -width 15 ] -column 4 -row 4
1024	grid [ label $expgui(diffBox).lDCipola -text "IPOLA" ] \
1025	-column 5 -row 4
1026	grid [ entry $expgui(diffBox).eDCipola -width 2 \
1027	-textvariable entryvar(ipola)] -column 6 -row 4
1028	} elseif {[string range $expmap(htype_$hist) 1 2] == "XC"} {
1029	#---------------------------
1030	# CW - x-ray 2 wavelengths \|
1031	#---------------------------
1032	grid [ label $expgui(diffBox).lDCdifc -text wavelengths ] \
1033	-column 3 -row 1 -sticky w
1034	grid [ entry $expgui(diffBox).eDCdifc -textvariable entryvar(lam1) \
1035	-width 15 ] -column 4 -row 1
1036	grid [ entry $expgui(diffBox).eDCdifa -textvariable entryvar(lam2) \
1037	-width 15 ] -column 5 -row 1
1038	#
1039	grid [ label $expgui(diffBox).lDCrref -text "Refine ratio" ] \
1040	-column 1 -row 2 -sticky w
1041	grid [ checkbutton $expgui(diffBox).rfDCrref \
1042	-variable entryvar(ratref) ] -column 2 -row 2
1043	grid [ label $expgui(diffBox).lDCratio -text Ratio ] \
1044	-column 3 -row 2
1045	grid [ entry $expgui(diffBox).eDCkratio \
1046	-textvariable entryvar(kratio) \
1047	-width 15 ] -column 4 -row 2
1048	#
1049	grid [ label $expgui(diffBox).lDCzero -text "Zero"] \
1050	-column 3 -row 3
1051	grid [ entry $expgui(diffBox).eDCzero -textvariable entryvar(zero) \
1052	-width 15 ] -column 4 -row 3
1053	grid [ label $expgui(diffBox).lDCzref -text "Refine zero" ] \
1054	-column 1 -row 3 -sticky w
1055	grid [ checkbutton $expgui(diffBox).rfDCzref \
1056	-variable entryvar(zref) ] -column 2 -row 3
1057	grid [ label $expgui(diffBox).lDCpref -text "Refine POLA" ] \
1058	-column 1 -row 4 -sticky w
1059	grid [ checkbutton $expgui(diffBox).rfDCpref \
1060	-variable entryvar(pref) ] -column 2 -row 4
1061	grid [ label $expgui(diffBox).lDCpola -text POLA ] \
1062	-column 3 -row 4
1063	grid [ entry $expgui(diffBox).eDCpola \
1064	-textvariable entryvar(pola) -width 15 ] -column 4 -row 4
1065	grid [ label $expgui(diffBox).lDCipola -text "IPOLA" ] \
1066	-column 5 -row 4
1067	grid [ entry $expgui(diffBox).eDCipola -width 2 \
1068	-textvariable entryvar(ipola)] -column 6 -row 4
1069	-variable entryvar(zref) ] -column 2 -row 3
1070	} elseif {[string range $expmap(htype_$hist) 1 2] == "XE"} {
1071	#-------------
1072	# ED - x-ray \|
1073	#-------------
1074	grid [ label $expgui(diffBox).lDC1 -text "Refine 2theta" ] \
1075	-column 1 -row 1
1076	grid [ checkbutton $expgui(diffBox).rfDC1 -variable entryvar(ttref) ] \
1077	-column 2 -row 1
1078	grid [ label $expgui(diffBox).lDCdifc -text 2Theta ] \
1079	-column 3 -row 1 -sticky w
1080	grid [ entry $expgui(diffBox).eDCdifc -textvariable entryvar(lam1) \
1081	-width 15 ] -column 4 -row 1
1082	#
1083	grid [ label $expgui(diffBox).lDCpref -text "Refine POLA" ] \
1084	-column 1 -row 4 -sticky w
1085	grid [ checkbutton $expgui(diffBox).rfDCpref \
1086	-variable entryvar(pref) ] -column 2 -row 4
1087	grid [ label $expgui(diffBox).lDCpola -text POLA ] \
1088	-column 3 -row 4
1089	grid [ entry $expgui(diffBox).eDCpola \
1090	-textvariable entryvar(pola) -width 15 ] -column 4 -row 4
1091	grid [ label $expgui(diffBox).lDCipola -text "IPOLA" ] \
1092	-column 5 -row 4
1093	grid [ entry $expgui(diffBox).eDCipola -width 2 \
1094	-textvariable entryvar(ipola)] -column 6 -row 4
1095	}
1096	} elseif {$expgui(globalmode) == 1} {
1097	#-------------
1098	# Global TOF \|
1099	#-------------
1100	grid [ label $expgui(diffBox).lDCrc -text "Refine DIFC" ] \
1101	-column 1 -row 1
1102	grid [ checkbutton $expgui(diffBox).rfDCrc -variable entryvar(dcref) ] \
1103	-column 2 -row 1
1104	grid [button $expgui(diffBox).bDCdifc -text "Set DIFC Globally" \
1105	-command "editglobalparm histinfo difc {DIFC}"] -column 3 -row 1
1106	#
1107	grid [ label $expgui(diffBox).lDCra -text "Refine DIFA" ] \
1108	-column 1 -row 2
1109	grid [ checkbutton $expgui(diffBox).rfDCra -variable entryvar(daref) ] \
1110	-column 2 -row 2
1111	grid [ button $expgui(diffBox).bDCdifa -text "Set DIFA Globally" \
1112	-command "editglobalparm histinfo difa {DIFA}"] -column 3 -row 2
1113	#
1114	grid [ label $expgui(diffBox).lDCzref -text "Refine zero" ] \
1115	-column 1 -row 3 -sticky w
1116	grid [ checkbutton $expgui(diffBox).rfDCzref \
1117	-variable entryvar(zref) ] -column 2 -row 3
1118	grid [ button $expgui(diffBox).bDCzero -text "Set ZERO Globally" \
1119	-command "editglobalparm histinfo zero {Zero}"] -column 3 -row 3
1120	} elseif {$expgui(globalmode) == 2} {
1121	#--------------------
1122	# Global CW neutron \|
1123	#--------------------
1124	grid [ label $expgui(diffBox).lDC1 -text "Refine wave" ] \
1125	-column 1 -row 1
1126	grid [ checkbutton $expgui(diffBox).rfDC1 -variable entryvar(wref) ] \
1127	-column 2 -row 1
1128	grid [button $expgui(diffBox).bDCdifc -text "Set Wave Globally" \
1129	-command "editglobalparm histinfo lam1 Wavelength"] \
1130	-column 3 -row 1
1131	#
1132	grid [ label $expgui(diffBox).lDCzref -text "Refine zero" ] \
1133	-column 1 -row 3 -sticky w
1134	grid [ checkbutton $expgui(diffBox).rfDCzref \
1135	-variable entryvar(zref) ] -column 2 -row 3
1136	grid [button $expgui(diffBox).bDCzero -text "Set Zero Globally" \
1137	-command "editglobalparm histinfo zero Zero"] -column 3 -row 3
1138	} elseif {$expgui(globalmode) == 4} {
1139	#----------------------
1140	# Global CW mono xray \|
1141	#----------------------
1142	grid [ label $expgui(diffBox).lDC1 -text "Refine wave" ] \
1143	-column 1 -row 1
1144	grid [ checkbutton $expgui(diffBox).rfDC1 -variable entryvar(wref) ] \
1145	-column 2 -row 1
1146	grid [button $expgui(diffBox).bDCdifc -text "Set Wave Globally" \
1147	-command "editglobalparm histinfo lam1 Wavelength"] \
1148	-column 3 -row 1
1149	#
1150	grid [ label $expgui(diffBox).lDCzref -text "Refine zero" ] \
1151	-column 1 -row 3 -sticky w
1152	grid [ checkbutton $expgui(diffBox).rfDCzref \
1153	-variable entryvar(zref) ] -column 2 -row 3
1154	grid [button $expgui(diffBox).bDCzero -text "Set Zero Globally" \
1155	-command "editglobalparm histinfo zero Zero"] -column 3 -row 3
1156	#
1157	grid [ label $expgui(diffBox).lDCpref -text "Refine POLA" ] \
1158	-column 1 -row 4 -sticky w
1159	grid [ checkbutton $expgui(diffBox).rfDCpref \
1160	-variable entryvar(pref) ] -column 2 -row 4
1161	grid [button $expgui(diffBox).bDCpola -text "Set POLA Globally" \
1162	-command "editglobalparm histinfo pola POLA"] -column 3 -row 4
1163	grid [button $expgui(diffBox).bDCipola -text "Set IPOLA Globally" \
1164	-command "editglobalparm histinfo ipola IPOLA"] -column 4 -row 4
1165	} elseif {$expgui(globalmode) == 3} {
1166	#------------------------
1167	# Global alpha 1,2 xray \|
1168	#------------------------
1169	grid [button $expgui(diffBox).bDCl1 -text "Set Wave1 Globally" \
1170	-command "editglobalparm histinfo lam1 {Wavelength 1}"] \
1171	-column 3 -row 1
1172	grid [button $expgui(diffBox).bDCl2 -text "Set Wave2 Globally" \
1173	-command "editglobalparm histinfo lam2 {Wavelength 2}"] \
1174	-column 4 -row 1
1175	#
1176	grid [ label $expgui(diffBox).lDCratref -text "Refine Ratio" ] \
1177	-column 1 -row 3 -sticky w
1178	grid [ checkbutton $expgui(diffBox).rfDCratref \
1179	-variable entryvar(ratref) ] -column 2 -row 3
1180	grid [button $expgui(diffBox).bDCrrat -text "Set Ratio Globally" \
1181	-command "editglobalparm histinfo ratio {Wavelength Ratio}"] \
1182	-column 3 -row 3
1183	#
1184	grid [ label $expgui(diffBox).lDCzref -text "Refine zero" ] \
1185	-column 1 -row 3 -sticky w
1186	grid [ checkbutton $expgui(diffBox).rfDCzref \
1187	-variable entryvar(zref) ] -column 2 -row 3
1188	grid [button $expgui(diffBox).bDCzero -text "Set Zero Globally" \
1189	-command "editglobalparm histinfo zero Zero"] -column 3 -row 3
1190	#
1191	grid [ label $expgui(diffBox).lDCpref -text "Refine POLA" ] \
1192	-column 1 -row 4 -sticky w
1193	grid [ checkbutton $expgui(diffBox).rfDCpref \
1194	-variable entryvar(pref) ] -column 2 -row 4
1195	grid [button $expgui(diffBox).bDCpola -text "Set POLA Globally" \
1196	-command "editglobalparm histinfo pola POLA"] -column 3 -row 4
1197	grid [button $expgui(diffBox).bDCipola -text "Set IPOLA Globally" \
1198	-command "editglobalparm histinfo ipola IPOLA"] -column 4 -row 4
1199	} elseif {$expgui(globalmode) == 5} {
1200	#-----------------
1201	# Global ED xray \|
1202	#-----------------
1203	grid [ label $expgui(diffBox).lDC1 -text "Refine 2theta" ] \
1204	-column 1 -row 1
1205	grid [ checkbutton $expgui(diffBox).rfDC1 -variable entryvar(ttref) ] \
1206	-column 2 -row 1
1207	grid [button $expgui(diffBox).bDCdifc -text "Set 2Theta Globally" \
1208	-command "editglobalparm histinfo ratio {Fixed 2Theta}"] \
1209	-column 3 -row 1
1210	#
1211	grid [ label $expgui(diffBox).lDCpref -text "Refine POLA" ] \
1212	-column 1 -row 4 -sticky w
1213	grid [ checkbutton $expgui(diffBox).rfDCpref \
1214	-variable entryvar(pref) ] -column 2 -row 4
1215	grid [button $expgui(diffBox).bDCpola -text "Set POLA Globally" \
1216	-command "editglobalparm histinfo pola POLA"] -column 3 -row 4
1217	grid [button $expgui(diffBox).bDCipola -text "Set IPOLA Globally" \
1218	-command "editglobalparm histinfo ipola IPOLA"] -column 4 -row 4
1219	}
1220	if {$expgui(globalmode) == 0} {
1221	grid [frame $expgui(diffBox).d] -column 5 -row 5 \
1222	-columnspan 2 -sticky e
1223	} else {
1224	grid [frame $expgui(diffBox).d] -column 4 -row 5 \
1225	-columnspan 2 -sticky e
1226	}
1227	grid [label $expgui(diffBox).d.lDamp -text "Damping "] \
1228	-column 1 -row 1
1229	tk_optionMenu $expgui(diffBox).d.om entryvar(ddamp) 0 1 2 3 4 5 6 7 8 9
1230	grid $expgui(diffBox).d.om -column 2 -row 1
1231	grid columnconfigure $expgui(diffBox) 9 -weight 1
1232	grid columnconfigure $expgui(diffBox) 0 -weight 1
1233	update idletasks
1234	# enable traces on entryvar now
1235	set entrycmd(trace) 1
1236	}
1237
1238	#-----------------------------------------------------------------------
1239	# populate the Phase Fraction page
1240	#-----------------------------------------------------------------------
1241	proc DisplayFrac {} {
1242	global expgui entrycmd entryvar expmap
1243
1244	# display the selected histograms
1245	$expgui(fracFrame).hs.lbox selection clear 0 end
1246	foreach h $expgui(curhist) {
1247	$expgui(fracFrame).hs.lbox selection set $h
1248	}
1249
1250	# disable traces on entryvar
1251	set entrycmd(trace) 0
1252
1253	# get histogram list
1254	set histlist {}
1255	foreach item $expgui(curhist) {
1256	lappend histlist [lindex $expmap(powderlist) $item]
1257	}
1258
1259	set phaseFractf1 $expgui(fracFrame).f1
1260	# destroy the contents of the frame
1261	eval destroy [pack slaves $phaseFractf1]
1262	if {$expgui(globalmode) != 0} {
1263	pack [frame $expgui(fracFrame).f1.top] \
1264	-side top -anchor center
1265	pack [label $expgui(fracFrame).f1.top.txt \
1266	-text "Selected Histograms: [CompressList $histlist]"] -side left
1267	}
1268	# Create the frame inside the canvas, One frame for each Phase.
1269	foreach i {1 2 3 4 5 6 7 8 9} {set phasehistlist($i) ""}
1270	foreach hist $histlist {
1271	foreach i $expmap(phaselist_$hist) {
1272	lappend phasehistlist($i) $hist
1273	}
1274	}
1275	foreach i {1 2 3 4 5 6 7 8 9} {
1276	if {[llength $phasehistlist($i)] == 0} continue
1277	set framePF [frame $phaseFractf1.pF$i -relief groove -bd 4]
1278	pack $framePF -pady 1 -side top -anchor w
1279
1280	# Label Heading for each phase.
1281	if {$expgui(globalmode) != 0} {
1282	grid [label $framePF.l1 \
1283	-text "Phase $i Hist: [CompressList $phasehistlist($i)] Phase Fraction"] \
1284	-column 0 -row 0 -sticky nws
1285	grid [button $framePF.but1 -text "Set Globally" \
1286	-command "editglobalparm hapinfo frac \"Phase $i Fraction\" \
1287	[list $phasehistlist($i)] $i" \
1288	] -column 1 -row 0
1289	} else {
1290	grid [label $framePF.l1 -text "Phase $i Phase fraction"] \
1291	-column 0 -row 0 -sticky nws
1292	grid [entry $framePF.ent -textvariable entryvar(frac$i) -width 15]\
1293	-column 1 -row 0
1294	}
1295	set entrycmd(frac$i) "hapinfo $hist $i frac"
1296	set entryvar(frac$i) [hapinfo $hist $i frac]
1297	grid [label $framePF.l2 -text " Refine"] \
1298	-column 2 -row 0 -sticky nws
1299	grid [checkbutton $framePF.cb -variable entryvar(frref$i)] \
1300	-column 3 -row 0 -sticky nws
1301	set entrycmd(frref$i) "hapinfo $hist $i frref"
1302	set entryvar(frref$i) [hapinfo $hist $i frref]
1303	grid [label $framePF.l3 -text " Damping"] \
1304	-column 4 -row 0 -sticky nws
1305	tk_optionMenu $framePF.tkOptDamp entryvar(frdamp$i) \
1306	0 1 2 3 4 5 6 7 8 9
1307	set entrycmd(frdamp$i) "hapinfo $hist $i frdamp"
1308	set entryvar(frdamp$i) [hapinfo $hist $i frdamp]
1309	grid $framePF.tkOptDamp -row 0 -sticky nsw -column 5
1310	}
1311	update idletasks
1312	# enable traces on entryvar now
1313	set entrycmd(trace) 1
1314	}
1315
1316	#-----------------------------------------------------------------------
1317	# display the profile page
1318	#-----------------------------------------------------------------------
1319	proc DisplayProfile {} {
1320	global expgui entrycmd entryvar expmap
1321	$expgui(profFrame).hs.lbox selection clear 0 end
1322	foreach h $expgui(curhist) {
1323	$expgui(profFrame).hs.lbox selection set $h
1324	}
1325
1326	# disable traces on entryvar for right now
1327	set entrycmd(trace) 0
1328	# destroy the contents of the frame
1329	eval destroy [grid slaves $expgui(ProfileBox).f]
1330
1331	if {$expgui(globalmode) == 0} {
1332	set hist [lindex $expmap(powderlist) $expgui(curhist)]
1333	# Create one frame for each Phase.
1334	set ind -1
1335	set htype [string range $expmap(htype_$hist) 2 2]
1336	foreach i $expmap(phaselist_$hist) {
1337	incr ind
1338	grid [frame $expgui(ProfileBox).f.$i -relief groove -bd 4] \
1339	-column 0 -row $ind -sticky ew
1340	grid [frame $expgui(ProfileBox).f.$i.1] \
1341	-column 0 -row 0 -columnspan 10 -sticky ew
1342	# Label Heading for each phase.
1343	set ptype [string trim [hapinfo $hist $i proftype]]
1344	pack [label $expgui(ProfileBox).f.$i.1.l \
1345	-text "Phase $i -- type $ptype Damping"]\
1346	-side left
1347	tk_optionMenu $expgui(ProfileBox).f.$i.1.tkOptDamp entryvar(pdamp_$i) \
1348	0 1 2 3 4 5 6 7 8 9
1349	set entrycmd(pdamp_$i) "hapinfo $hist $i pdamp"
1350	set entryvar(pdamp_$i) [hapinfo $hist $i pdamp]
1351	pack $expgui(ProfileBox).f.$i.1.tkOptDamp -side left
1352	pack [label $expgui(ProfileBox).f.$i.1.l1 \
1353	-text " Peak cutoff"]\
1354	-side left
1355	pack [entry $expgui(ProfileBox).f.$i.1.e1 \
1356	-width 10 -textvariable entryvar(pcut_$i)]\
1357	-side left
1358	set entrycmd(pcut_$i) "hapinfo $hist $i pcut"
1359	set entryvar(pcut_$i) [hapinfo $hist $i pcut]
1360
1361	set col -1
1362	set row 1
1363	set nterms [hapinfo $hist $i profterms]
1364	set lbls $expgui(prof-$htype-$ptype)
1365	# for type 4, add extra terms depending on the cell type
1366	if {$ptype == 4} {set lbls [type4lbls $lbls $nterms $i]}
1367	for { set num 1 } { $num <= $nterms } { incr num } {
1368	set term {}
1369	catch {set term [lindex $lbls $num]}
1370	if {$term == ""} {set term $num}
1371	incr col
1372	grid [label $expgui(ProfileBox).f.$i.l${num}_${i} -text "$term"] \
1373	-row $row -column $col
1374	incr col
1375	grid [checkbutton $expgui(ProfileBox).f.$i.ref${num}_${i} \
1376	-variable entryvar(pref${num}_$i)] -row $row -column $col
1377	set entrycmd(pref${num}_$i) "hapinfo $hist $i pref$num"
1378	set entryvar(pref${num}_$i) [hapinfo $hist $i pref$num]
1379	incr col
1380	grid [entry $expgui(ProfileBox).f.$i.ent${num}_${i} \
1381	-textvariable entryvar(pterm${num}_$i)\
1382	-width 14] -row $row -column $col
1383	set entrycmd(pterm${num}_$i) "hapinfo $hist $i pterm$num"
1384	set entryvar(pterm${num}_$i) [hapinfo $hist $i pterm$num]
1385	if {$col > 6} {set col -1; incr row}
1386	}
1387	}
1388	grid columnconfigure $expgui(ProfileBox).f 0 -weight 1
1389	} else {
1390	# get histogram list
1391	set histlist {}
1392	foreach item $expgui(curhist) {
1393	lappend histlist [lindex $expmap(powderlist) $item]
1394	}
1395	# loop through histograms & phases, set up an array by type
1396	catch {unset ptypearray histarray phasearray}
1397	foreach hist $histlist {
1398	foreach i $expmap(phaselist_$hist) {
1399	set ptype [string trim [hapinfo $hist $i proftype]]
1400	lappend ptypearray(${ptype}_$i) $hist
1401	lappend histarray($ptype) $hist
1402	lappend phasearray($ptype) $i
1403	}
1404	}
1405
1406	set ptype ""
1407	set title ""
1408	set ind -1
1409	foreach key "[lsort [array names ptypearray]] 0_0" {
1410	# split key
1411	scan $key %d_%d type p
1412	# 1st time through
1413	if {$ptype == ""} {set ptype $type}
1414	if {$ptype == $type} {
1415	# we've seen this one before
1416	if {$title != ""} {append title "\n"}
1417	append title "Phase $p, hist [CompressList $ptypearray($key)]"
1418	} else {
1419	set hist [lindex $histarray($ptype) 0]
1420	set phase [lindex $phasearray($ptype) 0]
1421	set nterms [hapinfo $hist $phase profterms]
1422	set htype [string range $expmap(htype_$hist) 2 2]
1423	set lbls $expgui(prof-$htype-$ptype)
1424	set i $ptype
1425	# Create one frame for this type
1426	incr ind
1427	grid [frame $expgui(ProfileBox).f.$i -relief groove -bd 4] \
1428	-column 0 -row $ind -sticky ew
1429	grid [frame $expgui(ProfileBox).f.$i.0] \
1430	-column 0 -row 0 -columnspan 20 -sticky ew
1431	grid [label $expgui(ProfileBox).f.$i.0.0 \
1432	-text "Profile Type $ptype "] -row 0 -column 0
1433	grid [label $expgui(ProfileBox).f.$i.0.1 \
1434	-text $title -anchor w] -row 0 -column 1
1435	grid [frame $expgui(ProfileBox).f.$i.1] \
1436	-column 0 -row 1 -columnspan 20 -sticky ew
1437	grid [label $expgui(ProfileBox).f.$i.1.2 \
1438	-text "Damping"] -row 0 -column 2
1439	tk_optionMenu $expgui(ProfileBox).f.$i.1.tkOptDamp \
1440	entryvar(pdamp_$ptype) 0 1 2 3 4 5 6 7 8 9
1441	set entrycmd(pdamp_$ptype) "hapinfo \
1442	[list $histarray($ptype)] \
1443	[list $phasearray($ptype)] pdamp"
1444	set entryvar(pdamp_$ptype) [hapinfo $hist $phase pdamp]
1445	grid $expgui(ProfileBox).f.$i.1.tkOptDamp -row 0 -column 3
1446	grid [button $expgui(ProfileBox).f.$i.1.edit \
1447	-text "Global Edit" \
1448	-command "EditProfile [list $title] \
1449	[list $histarray($ptype)] [list $phasearray($ptype)] " \
1450	] -row 0 -column 4 -sticky w
1451	# for type 4, add extra terms depending on the cell type
1452	if {$ptype == 4} {set lbls [type4lbls $lbls $nterms $phase]}
1453	set col -1
1454	set row 2
1455	for { set num 1 } { $num <= $nterms } { incr num } {
1456	set term {}
1457	catch {set term [lindex $lbls $num]}
1458	if {$term == ""} {set term $num}
1459	incr col
1460	grid [label $expgui(ProfileBox).f.$i.l${num}_${i} -text "$term"] \
1461	-row $row -column $col
1462	incr col
1463	grid [checkbutton $expgui(ProfileBox).f.$i.ref${num}_${i} \
1464	-variable entryvar(pref${num}_$i)] \
1465	-row $row -column $col
1466	set entrycmd(pref${num}_$i) "hapinfo \
1467	[list $histarray($ptype)] \
1468	[list $phasearray($ptype)] pref$num"
1469	set entryvar(pref${num}_$i) [hapinfo $hist $phase pref$num]
1470	if {$col > 10} {set col -1; incr row}
1471	}
1472	grid columnconfigure $expgui(ProfileBox).f 0 -weight 1
1473	set ptype ""
1474	}
1475	}
1476	}
1477
1478	# resize the scroll window to match the actual
1479	update idletasks
1480	$expgui(ProfileBox) config -scrollregion [grid bbox $expgui(ProfileBox).f]
1481	$expgui(ProfileBox) config -width [lindex [grid bbox $expgui(ProfileBox).f] 2]
1482	update idletasks
1483	# enable traces on entryvar now
1484	set entrycmd(trace) 1
1485	}
1486
1487	# profile labels for type 4 profile
1488	proc type4lbls {lbls nterms phase} {
1489	if {$nterms == 14} {
1490	# cubic
1491	lappend lbls S400 S220
1492	} elseif {$nterms == 15} {
1493	# hexagonal
1494	lappend lbls S400 S004 S202
1495	} elseif {$nterms == 16} {
1496	# tetragonal or rhombohedral
1497	if {[phaseinfo $phase a] == [phaseinfo $phase c]} {
1498	# rhombohedral
1499	lappend lbls S400 S220 S310 S211
1500	} else {
1501	lappend lbls S400 S004 S220 S202
1502	}
1503	} elseif {$nterms == 18} {
1504	# orthorhombic
1505	lappend lbls S400 S040 S004 S220 S202 S022
1506	} elseif {$nterms == 21} {
1507	# monoclinic
1508	lappend lbls S400 S040 S004 S220 S202 S022 S301 S103 S121
1509	} elseif {$nterms == 25} {
1510	# triclinic
1511	lappend lbls S400 S040 S004 S220 S202 S022 S310 S103 S031 \
1512	S130 S301 S013 S211 S121 S112
1513	}
1514	return $lbls
1515	}
1516
1517	# process the bit settings in the print options
1518	# bitnum -- the number of the bit to be tested/set starting at 0 for the LSBit
1519	proc printsetting {bitnum "action get" "value {}"} {
1520	global entryvar expgui
1521	if {$action == "get"} {
1522	return [expr ([expinfo print] & int(pow(2,$bitnum))) != 0]
1523	} elseif $value {
1524	set newval [expr ([expinfo print] \| int(pow(2,$bitnum)))]
1525	} else {
1526	set newval [expr ([expinfo print] & ~int(pow(2,$bitnum)))]
1527	}
1528	expinfo print set $newval
1529	set expgui(printopt) "Print Options ([expinfo print])"
1530	}
1531	#---------------------------- Global Edit Functions ------------------------
1532	proc editbackground {} {
1533	global expgui expmap entrycmd
1534	set w .back
1535	catch {destroy $w}
1536	toplevel $w -bg beige
1537	set histlist {}
1538	foreach n $expgui(curhist) {
1539	lappend histlist [lindex $expmap(powderlist) $n]
1540	}
1541	if {$expgui(globalmode) != 0} {
1542	wm title $w "Edit Background"
1543	} else {
1544	wm title $w "Global Edit Background"
1545	}
1546
1547	pack [frame $w.0 -bd 6 -relief groove -bg beige \
1548	] -side top -expand yes -fill both
1549	if {[llength $histlist] > 1} {
1550	grid [label $w.0.a \
1551	-text "Setting background terms for histograms [CompressList $histlist]" \
1552	-bg beige] -row 0 -column 0 -columnspan 10
1553	} else {
1554	grid [label $w.0.a \
1555	-text "Setting background terms for histogram $histlist" \
1556	-bg beige] -row 0 -column 0 -columnspan 10
1557	}
1558	set hist [lindex $histlist 0]
1559	grid [label $w.0.b -text "Function type" -bg beige] -row 1 -column 0
1560
1561	# disable traces on expgui(backtype) & expgui(backterms) now
1562	set entrycmd(trace) 0
1563
1564	# number of terms
1565	set expgui(backtype) [histinfo $hist backtype]
1566	set expgui(orig_backtype) $expgui(backtype)
1567	set expgui(prev_backtype) $expgui(backtype)
1568	eval tk_optionMenu $w.0.type expgui(backtype) {1 2 3 4 5 6}
1569	grid $w.0.type -row 1 -column 1
1570	grid [label $w.0.c -text " Number of terms" -bg beige] -row 1 -column 2
1571
1572	# function type
1573	set expgui(backterms) [histinfo $hist backterms]
1574	set expgui(orig_backterms) $expgui(backterms)
1575	set list {}; for {set i 1} {$i <= 36} {incr i} {lappend list $i}
1576	eval tk_optionMenu $w.0.terms expgui(backterms) $list
1577	grid $w.0.terms -row 1 -column 3
1578	# enable traces on expgui(backtype) & expgui(backterms) now
1579	set entrycmd(trace) 1
1580
1581	#set background terms
1582	for {set num 1 } { $num <= 36 } { incr num } {
1583	set var "bterm$num"
1584	set expgui($var) {}
1585	set expgui(orig_$var) {}
1586	}
1587	if {[llength $histlist] == 1} {
1588	for {set num 1 } { $num <= $expgui(backterms) } { incr num } {
1589	set var "bterm$num"
1590	set expgui($var) [histinfo $histlist $var]
1591	set expgui(orig_$var) $expgui($var)
1592	}
1593	}
1594
1595	pack [frame $w.1 -bd 6 -relief groove -bg beige] -side top \
1596	-expand yes -fill both
1597	ShowBackTerms $w.1
1598
1599	set expgui(temp) {}
1600	pack [frame $w.b] -side top
1601	pack [button $w.b.2 -text Set -command "destroy $w"] -side left
1602	pack [button $w.b.3 -text Quit \
1603	-command "QuitEditBackground $w"] -side left
1604	# force the window to stay on top
1605	wm transient $w [winfo toplevel [winfo parent $w]]
1606
1607	bind $w <Return> "destroy $w"
1608	wm withdraw $w
1609	update idletasks
1610	# center the new window in the middle of the parent
1611	set x [expr [winfo x [winfo parent $w]] + [winfo width .]/2 - \
1612	[winfo reqwidth $w]/2 - [winfo vrootx [winfo parent $w]]]
1613	set y [expr [winfo y [winfo parent $w]] + [winfo height .]/2 - \
1614	[winfo reqheight $w]/2 - [winfo vrooty [winfo parent $w]]]
1615	wm geom $w +$x+$y
1616	wm deiconify $w
1617
1618	set oldFocus [focus]
1619	set oldGrab [grab current $w]
1620	if {$oldGrab != ""} {
1621	set grabStatus [grab status $oldGrab]
1622	}
1623	grab $w
1624	focus $w.b.2
1625	tkwait window $w
1626
1627	catch {focus $oldFocus}
1628	if {$oldGrab != ""} {
1629	if {$grabStatus == "global"} {
1630	grab -global $oldGrab
1631	} else {
1632	grab $oldGrab
1633	}
1634	}
1635
1636	if {$expgui(temp) != ""} return
1637
1638	if {$expgui(orig_backtype) != $expgui(backtype)} {
1639	histinfo $histlist backtype set $expgui(backtype)
1640	}
1641	if {$expgui(orig_backterms) != $expgui(backterms)} {
1642	histinfo $histlist backterms set $expgui(backterms)
1643	}
1644	for {set num 1 } { $num <= $expgui(backterms) } { incr num } {
1645	set var "bterm$num"
1646	if {$expgui(orig_$var) != $expgui($var)} {
1647	histinfo $histlist $var set $expgui($var)
1648	}
1649	}
1650
1651	if {$expgui(globalmode) == 0} {
1652	set expgui(backtypelbl) "Function type [histinfo $hist backtype]"
1653	set expgui(backtermlbl) "([histinfo $hist backterms] terms)"
1654	}
1655	}
1656
1657	trace variable expgui(backterms) w ChangeBackTerms
1658	proc ChangeBackTerms {a b c} {
1659	global entrycmd expgui
1660	if !$entrycmd(trace) return
1661	ShowBackTerms .back.1
1662	}
1663
1664	trace variable expgui(backtype) w ChangeBackType
1665	# reset the terms to 1, 0, 0... when the number of terms increase
1666	proc ChangeBackType {a b c} {
1667	global entrycmd expgui
1668	if !$entrycmd(trace) return
1669	if {$expgui(prev_backtype) == $expgui(backtype)} return
1670	set expgui(prev_backtype) $expgui(backtype)
1671	for {set num 1 } { $num <= $expgui(backterms) } { incr num } {
1672	set var "bterm$num"
1673	if {$num == 1} {
1674	set expgui($var) 1.0
1675	} else {
1676	set expgui($var) 0.0
1677	}
1678	}
1679	}
1680
1681	proc ShowBackTerms {w } {
1682	global expgui expmap
1683	# destroy the contents of the frame
1684	eval destroy [grid slaves $w]
1685	set histlist {}
1686	foreach n $expgui(curhist) {
1687	lappend histlist [lindex $expmap(powderlist) $n]
1688	}
1689	set widgetsPerRow 4
1690	for {set rows 2; set num 1 } { $num <= $expgui(backterms) } { incr rows } {
1691	for {set cols 0} { (2*$widgetsPerRow > $cols) && ($num <= $expgui(backterms)) } { incr num } {
1692	set var "bterm$num"
1693	grid [label $w.l$num -text $num -bg beige] \
1694	-row $rows -column $cols -sticky nes
1695	incr cols
1696	grid [entry $w.e$num -width 15 -textvariable expgui($var) \
1697	] -row $rows -column $cols -sticky news
1698	incr cols
1699	}
1700	}
1701	}
1702
1703	proc QuitEditBackground {w} {
1704	global expgui
1705	# lets find out if anything changed
1706	set changed 0
1707	if {$expgui(orig_backtype) != $expgui(backtype)} {
1708	set changed 1
1709	}
1710	if {$expgui(orig_backterms) != $expgui(backterms)} {
1711	set changed 1
1712	}
1713	for {set num 1 } { $num <= $expgui(backterms) } { incr num } {
1714	set var "bterm$num"
1715	if {$expgui(orig_$var) != $expgui($var)} {
1716	set changed 1
1717	break
1718	}
1719	}
1720	if $changed {
1721	set decision [tk_dialog .changes "Abandon Changes" \
1722	"You have made changes to the background. Ok to abandon changes?" \
1723	warning 0 Abandon Keep]
1724	if !$decision {
1725	set expgui(temp) "Quit"
1726	destroy $w
1727	}
1728	} else {
1729	set expgui(temp) "Quit"
1730	destroy $w
1731	}
1732	}
1733
1734	# this probably needs work
1735	proc editglobalparm {cmd variable title "histlist {}" "phase {}"} {
1736	global expgui expmap
1737	set w .global
1738	catch {destroy $w}
1739	toplevel $w -bg beige
1740	wm title $w "Edit Global Parameter"
1741	set expgui(temp) {}
1742	if {[llength $histlist] == 0} {
1743	set hist {}
1744	foreach n $expgui(curhist) {
1745	lappend hist [lindex $expmap(powderlist) $n]
1746	}
1747	} else {
1748	set hist $histlist
1749	}
1750	pack [frame $w.0 -bd 6 -relief groove -bg beige] \
1751	-side top -expand yes -fill both
1752	grid [label $w.0.a -text "Setting $title for histograms [CompressList $hist]"\
1753	-bg beige] \
1754	-row 0 -column 0 -columnspan 10
1755	grid [entry $w.0.b -textvariable expgui(temp)] \
1756	-row 1 -column 0
1757
1758
1759	pack [frame $w.b] -side top
1760	pack [button $w.b.2 -text Set -command "destroy $w"] -side left
1761	pack [button $w.b.3 -text Quit -command "set expgui(temp) {}; destroy $w"] -side left
1762	# force the window to stay on top
1763	wm transient $w [winfo toplevel [winfo parent $w]]
1764
1765	bind $w <Return> "destroy $w"
1766	wm withdraw $w
1767	update idletasks
1768	# center the new window in the middle of the parent
1769	set x [expr [winfo x [winfo parent $w]] + [winfo width .]/2 - \
1770	[winfo reqwidth $w]/2 - [winfo vrootx [winfo parent $w]]]
1771	set y [expr [winfo y [winfo parent $w]] + [winfo height .]/2 - \
1772	[winfo reqheight $w]/2 - [winfo vrooty [winfo parent $w]]]
1773	wm geom $w +$x+$y
1774	wm deiconify $w
1775
1776	set oldFocus [focus]
1777	set oldGrab [grab current $w]
1778	if {$oldGrab != ""} {
1779	set grabStatus [grab status $oldGrab]
1780	}
1781	grab $w
1782	focus $w.b.2
1783	tkwait window $w
1784	if {$expgui(temp) != ""} {
1785	foreach h $hist {
1786	if {$cmd == "histinfo"} {
1787	histinfo $h $variable set $expgui(temp)
1788	if $expgui(debug) {
1789	puts "histinfo $h $variable set $expgui(temp)"
1790	}
1791	} elseif {$cmd == "hapinfo"} {
1792	hapinfo $h $phase $variable set $expgui(temp)
1793	if $expgui(debug) {
1794	puts "hapinfo $phase $h $variable set $expgui(temp)"
1795	}
1796	} else {
1797	error "$cmd unimplemented"
1798	}
1799	}
1800	}
1801	catch {focus $oldFocus}
1802	if {$oldGrab != ""} {
1803	if {$grabStatus == "global"} {
1804	grab -global $oldGrab
1805	} else {
1806	grab $oldGrab
1807	}
1808	}
1809	}
1810
1811	proc EditProfile {title histlist phaselist} {
1812	global expgui expmap entrycmd
1813	set w .back
1814	catch {destroy $w}
1815	toplevel $w -bg beige
1816	wm title $w "Global Edit Profile"
1817	set hist [lindex $histlist 0]
1818	set phase [lindex $phaselist 0]
1819	set ptype [string trim [hapinfo $hist $phase proftype]]
1820	set htype [string range $expmap(htype_$hist) 2 2]
1821	set nterms [hapinfo $hist $phase profterms]
1822
1823	pack [frame $w.0 -bd 6 -relief groove -bg beige \
1824	] -side top -expand yes -fill both
1825	grid [label $w.0.a \
1826	-text "Setting profile terms: $title" \
1827	-bg beige] -row 0 -column 0 -columnspan 10
1828	grid [label $w.0.b -text "Function type $ptype" -bg beige] -row 1 -column 0
1829
1830	# number of terms
1831	# set expgui(backtype) [histinfo $hist backtype]
1832	# set expgui(orig_backtype) $expgui(backtype)
1833	# set expgui(prev_backtype) $expgui(backtype)
1834	# eval tk_optionMenu $w.0.type expgui(backtype) {1 2 3 4 5 6}
1835	# grid $w.0.type -row 1 -column 1
1836
1837	grid [label $w.0.c -text " Peak cutoff" -bg beige] -row 1 -column 3
1838	grid [entry $w.0.d -width 10 ] -row 1 -column 4
1839	set entrylist {}
1840	lappend entrylist "pcut $w.0.d"
1841
1842	set col -1
1843	set row 1
1844	set lbls $expgui(prof-$htype-$ptype)
1845	# for type 4, add extra terms depending on the cell type
1846	if {$ptype == 4} {set lbls [type4lbls $lbls $nterms $i]}
1847	pack [frame $w.1 -bd 6 -relief groove -bg beige \
1848	] -side top -expand yes -fill both
1849	for { set num 1 } { $num <= $nterms } { incr num } {
1850	set term {}
1851	catch {set term [lindex $lbls $num]}
1852	if {$term == ""} {set term $num}
1853	incr col
1854	grid [label $w.1.l${num} -text "$term" -bg beige] \
1855	-row $row -column $col
1856	incr col
1857	grid [entry $w.1.ent${num} \
1858	-width 14] -row $row -column $col
1859	lappend entrylist "pterm$num $w.1.ent${num}"
1860	if {$col > 6} {set col -1; incr row}
1861	}
1862	pack [frame $w.b] -side top
1863	pack [button $w.b.2 -text Set \
1864	-command "SetEditProfile [list $entrylist] [list $phaselist] \
1865	[list $histlist] $w"] -side left
1866	pack [button $w.b.3 -text Quit \
1867	-command "QuitEditProfile $w [list $entrylist]"] -side left
1868	# force the window to stay on top
1869	wm transient $w [winfo toplevel [winfo parent $w]]
1870
1871	bind $w <Return> "destroy $w"
1872	wm withdraw $w
1873	update idletasks
1874	# center the new window in the middle of the parent
1875	set x [expr [winfo x [winfo parent $w]] + [winfo width .]/2 - \
1876	[winfo reqwidth $w]/2 - [winfo vrootx [winfo parent $w]]]
1877	set y [expr [winfo y [winfo parent $w]] + [winfo height .]/2 - \
1878	[winfo reqheight $w]/2 - [winfo vrooty [winfo parent $w]]]
1879	wm geom $w +$x+$y
1880	wm deiconify $w
1881
1882	set oldFocus [focus]
1883	set oldGrab [grab current $w]
1884	if {$oldGrab != ""} {
1885	set grabStatus [grab status $oldGrab]
1886	}
1887	grab $w
1888	focus $w.b.2
1889	tkwait window $w
1890
1891	catch {focus $oldFocus}
1892	if {$oldGrab != ""} {
1893	if {$grabStatus == "global"} {
1894	grab -global $oldGrab
1895	} else {
1896	grab $oldGrab
1897	}
1898	}
1899	}
1900
1901	proc SetEditProfile {entrylist phaselist histlist w} {
1902	global expgui
1903	foreach item $entrylist {
1904	set value [ [lindex $item 1] get ]
1905	if {$value != ""} {
1906	hapinfo $histlist $phaselist [lindex $item 0] set $value
1907	if $expgui(debug) {
1908	puts "hapinfo [list $phaselist] [list $histlist] [lindex $item 0] set $value"
1909	}
1910	}
1911	}
1912	destroy $w
1913	}
1914
1915	proc QuitEditProfile {w entrylist} {
1916	global expgui
1917	# lets find out if anything changed
1918	set changed 0
1919	foreach item $entrylist {
1920	if {[ [lindex $item 1] get ] != ""} {set changed 1; break}
1921	}
1922	if $changed {
1923	set decision [tk_dialog .changes "Abandon Changes" \
1924	"You have made changes to the Profile. Ok to abandon changes?" \
1925	warning 0 Abandon Keep]
1926	if !$decision {destroy $w}
1927	} else {
1928	destroy $w
1929	}
1930	}
1931
1932	##############################################################################
1933	## #############################################
1934	## END OF THE PROCEDURES SECTION #############################################
1935	## #############################################
1936	##############################################################################
1937
1938	# <<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<<
1939	# <<<<<<<<<<<<<<<<<<<<<<<<<<<<<< <<<<<<<<<<<<<<<<<<<
1940	# <<<<<<<<<<<<<<<<<<<<<<<<<<<<<< BEGIN: GUI SECTION >>>>>>>>>>>>>>>>>>>
1941	# >>>>>>>>>>>>>>>>>>>>>>>>>>>>>> >>>>>>>>>>>>>>>>>>>
1942	# >>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>>
1943	# A frame for menu items at top of display
1944	set expgui(fm) [frame .fm -relief raised -borderwidth 2 -width 150 -height 40]
1945	# Pack the menu frame.
1946	pack $expgui(fm) -fill x -side top -anchor n
1947
1948	# Creating the notebook with 5 panes: Phase, Histogram, Phase Fraction, Profile
1949	# & LS controls
1950	if $expgui(havetix) {
1951	pack [tixNoteBook .n] -expand yes -fill both
1952	.n add phasePane -label "Phase" -underline 0
1953	.n pageconfigure phasePane -raisecmd \
1954	"set expgui(pagenow) phaseFrame; DisplayAllAtoms noreset"
1955	.n add histPane -label "Histogram" -underline 0
1956	.n pageconfigure histPane -raisecmd \
1957	"set expgui(pagenow) histFrame; DisplayHistogram"
1958	lappend expgui(frameactionlist) "histFrame DisplayHistogram"
1959	lappend expgui(GlobalModeAllDisable) "histFrame {.n pageconfigure histPane}"
1960	.n add fracPane -label "Phase Fraction" -underline 6
1961	.n pageconfigure fracPane -raisecmd \
1962	"set expgui(pagenow) fracFrame; DisplayFrac"
1963	lappend expgui(frameactionlist) "fracFrame DisplayFrac"
1964	.n add profPane -label Profile -underline 1
1965	.n pageconfigure profPane -raisecmd \
1966	"set expgui(pagenow) profFrame; DisplayProfile"
1967	lappend expgui(frameactionlist) "profFrame DisplayProfile"
1968	lappend expgui(GlobalModeAllDisable) "profFrame {.n pageconfigure profPane}"
1969	.n add lsPane -label "LS Controls" -underline 0
1970	.n pageconfigure lsPane -raisecmd \
1971	"set expgui(pagenow) lsFrame; SetupExtractHist"
1972	lappend expgui(frameactionlist) "lsFrame SetupExtractHist"
1973	# Finding the pathname to the subwidget frames.
1974	set expgui(phaseFrame) [.n subwidget phasePane]
1975	set expgui(histFrame) [.n subwidget histPane]
1976	set expgui(fracFrame) [.n subwidget fracPane]
1977	set expgui(profFrame) [.n subwidget profPane]
1978	set expgui(lsFrame) [.n subwidget lsPane]
1979	} else {
1980	pack [frame .bar] -side top -anchor w
1981	pack [frame .n] -anchor w -fill both -expand yes
1982	foreach item {phaseFrame histFrame fracFrame profFrame lsFrame} \
1983	page {Phase Histogram "Phase Fraction" Profile "LS Controls"} {
1984	pack [button .bar.$item -text $page -bd 2 \
1985	-command "RaisePage $item"] -side left
1986	set expgui($item) [frame .n.$item -relief flat]
1987	}
1988	lappend expgui(frameactionlist) "histFrame DisplayHistogram"
1989	lappend expgui(frameactionlist) "fracFrame DisplayFrac"
1990	lappend expgui(frameactionlist) "profFrame DisplayProfile"
1991	lappend expgui(frameactionlist) "lsFrame SetupExtractHist"
1992	lappend expgui(GlobalModeAllDisable) "histFrame {.bar.histFrame config}"
1993	lappend expgui(GlobalModeAllDisable) "profFrame {.bar.profFrame config}"
1994	}
1995
1996	# this is used in the non-tix notebook to bring up the selected frame
1997	proc RaisePage {nextpage} {
1998	global expgui
1999	set expgui(pagenow) $nextpage
2000	foreach item {phaseFrame histFrame fracFrame profFrame lsFrame} {
2001	if {$item == $nextpage} {
2002	.bar.$item config -relief flat
2003	} else {
2004	.bar.$item config -relief raised
2005	}
2006	}
2007	# forget all other pages
2008	foreach child [pack slaves .n] {
2009	pack forget $child
2010	}
2011	pack .n.$nextpage -anchor w -fill both -expand yes
2012	foreach set $expgui(frameactionlist) {
2013	if {$expgui(pagenow) == [lindex $set 0]} [lindex $set 1]
2014	}
2015	}
2016	#----------------------------------------------------------------------------
2017	#\/ \/ \/ \/ \/ \/ \/ BEGINNING OF PHASE PANE CODE \/ \/ \/ \/ \/ \/ \/ \/ \/
2018	# Setup major frames here
2019	frame $expgui(phaseFrame).top
2020	set frameLatt [frame $expgui(phaseFrame).frameLatt]
2021	# This is a big frame in the Phase notebook pane to hold a list of CRS data.
2022	set fbig [frame $expgui(phaseFrame).fbig -width 180 -relief raised -borderwidth 4 -bg beige]
2023	# This is a frame just below the big frame: fbig to allow edit of CRS data, One record at a time.
2024	set frame3 [frame $expgui(phaseFrame).frame3 -width 100 -relief raised -borderwidth 4 -bg beige]
2025
2026	grid $expgui(phaseFrame).top -sticky nws -row 0 -column 0
2027	grid $frameLatt -sticky news -row 2 -column 0
2028	grid $fbig -sticky news -row 3 -column 0
2029	# give extra space to the atoms box
2030	grid columnconfigure $expgui(phaseFrame) 0 -weight 1
2031	grid rowconfigure $expgui(phaseFrame) 3 -weight 1
2032	grid $frame3 -sticky news -row 4 -column 0
2033	grid columnconfigure $expgui(phaseFrame) 0 -weight 1
2034	grid rowconfigure $expgui(phaseFrame) 3 -weight 1
2035	grid [frame $expgui(phaseFrame).top.ps] -column 0 -row 0
2036	# this is where the buttons will go
2037	pack [label $expgui(phaseFrame).top.ps.0 -text "Phases: "] -side left
2038
2039
2040	grid [label $expgui(phaseFrame).top.lA -textvariable entryvar(phasename) \
2041	-fg blue -anchor center] -column 1 -row 0
2042	grid columnconfigure $expgui(phaseFrame).top 1 -weight 1
2043	# ------------- Lattice Parameter Box ------------------
2044	set e1 [entry $frameLatt.e1 -textvariable entryvar(a) -width 10]
2045	set e2 [entry $frameLatt.e2 -textvariable entryvar(b) -width 10]
2046	set e3 [entry $frameLatt.e3 -textvariable entryvar(c) -width 10]
2047	set e4 [entry $frameLatt.e4 -textvariable entryvar(alpha) -width 10]
2048	set e5 [entry $frameLatt.e5 -textvariable entryvar(beta) -width 10]
2049	set e6 [entry $frameLatt.e6 -textvariable entryvar(gamma) -width 10]
2050	set l1 [label $frameLatt.l1 -text "a"]
2051	set l2 [label $frameLatt.l2 -text "b"]
2052	set l3 [label $frameLatt.l3 -text "c"]
2053	set l4 [label $frameLatt.l4 -text "alpha"]
2054	set l5 [label $frameLatt.l5 -text "beta"]
2055	set l6 [label $frameLatt.l6 -text "gamma"]
2056	grid $e1 -column 1 -row 0 -padx 5
2057	grid $e2 -column 3 -row 0 -padx 5
2058	grid $e3 -column 5 -row 0 -padx 5
2059	grid $e4 -column 1 -row 1 -padx 5
2060	grid $e5 -column 3 -row 1 -padx 5
2061	grid $e6 -column 5 -row 1 -padx 5
2062	grid $l1 -column 0 -row 0 -padx 5 -sticky e
2063	grid $l2 -column 2 -row 0 -padx 5 -sticky e
2064	grid $l3 -column 4 -row 0 -padx 5 -sticky e
2065	grid $l4 -column 0 -row 1 -padx 5 -sticky e
2066	grid $l5 -column 2 -row 1 -padx 5 -sticky e
2067	grid $l6 -column 4 -row 1 -padx 5 -sticky e
2068
2069	grid [label $frameLatt.lr -text "Refine Cell"] -column 6 -row 0 -padx 5 -sticky e
2070	grid [label $frameLatt.ld -text "Cell damping"] -column 6 -row 1 -padx 5 -sticky e
2071	set cFlag [checkbutton $frameLatt.c -text "" -variable entryvar(cellref)]
2072	grid $cFlag -column 7 -row 0 -padx 5 -sticky e
2073	tk_optionMenu $frameLatt.om entryvar(celldamp) 0 1 2 3 4 5 6 7 8 9
2074	grid $frameLatt.om -column 7 -row 1 -padx 5 -sticky e
2075
2076	#-------------- Begin Atom Coordinates Box ---------------------------------
2077	grid [listbox $fbig.title -height 1 -relief flat] \
2078	-row 0 -column 0 -sticky ew
2079	set expgui(atomtitle) $fbig.title
2080	$expgui(atomtitle) configure -font $expgui(coordfont) -selectmode extended
2081	grid [listbox $fbig.lbox -height 10 \
2082	-xscrollcommand " $fbig.bscr set"\
2083	-yscrollcommand " $fbig.rscr set"\
2084	] -row 1 -column 0 -sticky news
2085	set expgui(atomlistbox) $fbig.lbox
2086	$expgui(atomlistbox) configure -font $expgui(coordfont) -selectmode extended
2087	grid [scrollbar $fbig.bscr -orient horizontal \
2088	-command "move2boxes \" $fbig.title $fbig.lbox \" "
2089	] -row 2 -column 0 -sticky ew
2090	grid [scrollbar $fbig.rscr -command "$fbig.lbox yview" \
2091	] -row 1 -column 1 -sticky ns
2092	# give extra space to the atoms box
2093	grid columnconfigure $fbig 0 -weight 1
2094	grid rowconfigure $fbig 1 -weight 1
2095
2096	proc move2boxes {boxlist args} {
2097	foreach listbox $boxlist {
2098	eval $listbox xview $args
2099	}
2100	}
2101	# BIND mouse in editbox
2102	bind $expgui(atomlistbox) <ButtonRelease-1> editRecord
2103	bind $expgui(atomlistbox) <Button-3> SelectAllAtoms
2104
2105	#-------------- End Atoms Section ---------------------------------
2106
2107	# --------------------------- Begin Edit Box -------------------------------
2108	grid [set expgui(EditingAtoms) [label $frame3.top -bg beige -fg blue]] \
2109	-column 0 -row 0 -padx 2 -pady 3 -columnspan 12 -sticky w
2110
2111	set f3l1 [label $frame3.l1 -text "Refinement Flags " -bg beige]
2112	grid $f3l1 -column 0 -row 1 -padx 2 -sticky nsw -pady 3
2113
2114	set f3cFlag1 [checkbutton $frame3.cf1 -text "X" -variable entryvar(xref) -bg beige]
2115	set f3cFlag2 [checkbutton $frame3.cf2 -text "U" -variable entryvar(uref) -bg beige]
2116	set f3cFlag3 [checkbutton $frame3.cf3 -text "F" -variable entryvar(fref) -bg beige]
2117	grid $f3cFlag1 -column 1 -row 1 -padx 2 -pady 3 -sticky w
2118	grid $f3cFlag2 -column 2 -row 1 -padx 2 -pady 3 -sticky w
2119	grid $f3cFlag3 -column 3 -row 1 -padx 2 -pady 3 -sticky w
2120
2121	set f3l4 [label $frame3.l4 -text "Damping Factors " -bg beige]
2122	grid $f3l4 -column 4 -row 1 -padx 2 -sticky nsw -pady 3
2123
2124	tk_optionMenu $frame3.om2 entryvar(xdamp) 0 1 2 3 4 5 6 7 8 9
2125	tk_optionMenu $frame3.om3 entryvar(udamp) 0 1 2 3 4 5 6 7 8 9
2126	tk_optionMenu $frame3.om4 entryvar(fdamp) 0 1 2 3 4 5 6 7 8 9
2127	grid [label $frame3.lom2 -text X -bg beige] -column 5 -row 1 -padx 2 -pady 3 -sticky w
2128	grid $frame3.om2 -column 6 -row 1 -padx 2 -pady 3 -sticky w
2129	grid [label $frame3.lom3 -text U -bg beige] -column 7 -row 1 -padx 2 -pady 3 -sticky w
2130	grid $frame3.om3 -column 8 -row 1 -padx 2 -pady 3 -sticky w
2131	grid [label $frame3.lom4 -text F -bg beige] -column 9 -row 1 -padx 2 -pady 3 -sticky w
2132	grid $frame3.om4 -column 10 -row 1 -padx 2 -pady 3 -sticky w
2133
2134	set expgui(atomreflbl) "$frame3.l1 $frame3.l4 $frame3.lom2 $frame3.lom3 $frame3.lom4 "
2135	set expgui(atomref) "$frame3.cf1 $frame3.cf2 $frame3.cf3 $frame3.om2 $frame3.om3 $frame3.om4"
2136
2137	set coords [frame $frame3.coords -width 100 -borderwidth 0 -bg beige]
2138	grid $coords -column 0 -row 6 -columnspan 12 -sticky nsew
2139
2140	set f3l1 [label $frame3.coords.l1 -text "Label" -bg beige]
2141	set f3e1 [entry $frame3.coords.e1 -textvariable entryvar(label) -width 6]
2142	set f3l8 [label $frame3.coords.l8 -text "Coordinates" -bg beige]
2143	set f3e8 [entry $frame3.coords.e8 -textvariable entryvar(x) -width 10]
2144	set f3e9 [entry $frame3.coords.e9 -textvariable entryvar(y) -width 10]
2145	set f3e10 [entry $frame3.coords.e10 -textvariable entryvar(z) -width 10]
2146	set f3l11 [label $frame3.coords.l11 -text "Occupancy" -bg beige]
2147	set f3e11 [entry $frame3.coords.e11 -textvariable entryvar(frac) -width 10]
2148	set expgui(atomlabels) "$frame3.coords.l1 $frame3.coords.l8 $frame3.coords.l11"
2149	set expgui(atomentry) "$frame3.coords.e1 $frame3.coords.e8 $frame3.coords.e9 $frame3.coords.e10 $frame3.coords.e11"
2150
2151	grid $f3l1 -column 0 -row 4 -padx 2 -sticky nsw -pady 3
2152	grid $f3e1 -column 1 -row 4 -padx 2 -sticky nsw -pady 3
2153	grid $f3l8 -column 2 -row 4 -padx 2 -sticky nsw -pady 3
2154	grid $f3e8 -column 3 -row 4 -padx 2 -sticky nsw -pady 3
2155	grid $f3e9 -column 4 -row 4 -padx 2 -sticky nsw -pady 3
2156	grid $f3e10 -column 5 -row 4 -padx 2 -sticky nsw -pady 3
2157	grid $f3l11 -column 6 -row 4 -padx 2 -sticky nsw -pady 3
2158	grid $f3e11 -column 7 -row 4 -padx 2 -sticky nsw -pady 3
2159
2160
2161	set f3f31 [frame $frame3.f3f31 -width 100 -borderwidth 0 -bg beige]
2162	grid $f3f31 -column 0 -row 7 -columnspan 12
2163	set expgui(anisolabels) {}
2164	lappend expgui(anisolabels) [label $f3f31.l13 -text "Uiso" -bg beige]
2165	lappend expgui(anisolabels) [label $f3f31.l14 -text "U22" -bg beige]
2166	lappend expgui(anisolabels) [label $f3f31.l15 -text "U33" -bg beige]
2167	lappend expgui(anisolabels) [label $f3f31.l16 -text "U12" -bg beige]
2168	lappend expgui(anisolabels) [label $f3f31.l17 -text "U13" -bg beige]
2169	lappend expgui(anisolabels) [label $f3f31.l18 -text "U23" -bg beige]
2170
2171	set expgui(anisoentry) {}
2172	lappend expgui(anisoentry) [entry $f3f31.e13 -textvariable entryvar(U11) -width 10]
2173	lappend expgui(anisoentry) [entry $f3f31.e14 -textvariable entryvar(U22) -width 10]
2174	lappend expgui(anisoentry) [entry $f3f31.e15 -textvariable entryvar(U33) -width 10]
2175	lappend expgui(anisoentry) [entry $f3f31.e16 -textvariable entryvar(U12) -width 10]
2176	lappend expgui(anisoentry) [entry $f3f31.e17 -textvariable entryvar(U13) -width 10]
2177	lappend expgui(anisoentry) [entry $f3f31.e18 -textvariable entryvar(U23) -width 10]
2178
2179	set col 0
2180	foreach item1 $expgui(anisolabels) item2 $expgui(anisoentry) {
2181	grid $item1 -column $col -row 0 -sticky nsw -pady 3
2182	incr col
2183	grid $item2 -column $col -row 0 -sticky nsw -pady 3
2184	incr col
2185	}
2186	# --------------------------- End Edit Box --------------------------------
2187
2188	#/\ /\ /\ /\ /\ /\ /\ END OF PHASE PANE CODE /\ /\ /\ /\ /\ /\ /\ /\ /\ /\ /\
2189	#-----------------------------------------------------------------------------
2190	#v v v v v v v v v v BEGINNING OF HISTOGRAM PANE CODE v v v v v v v v v v v v
2191	grid [frame $expgui(histFrame).hs] \
2192	-column 0 -row 0 -rowspan 10 -sticky nsew
2193	grid columnconfigure $expgui(histFrame) 0 -weight 1
2194	grid rowconfigure $expgui(histFrame) 1 -weight 1
2195	grid rowconfigure $expgui(histFrame) 2 -weight 1
2196	grid rowconfigure $expgui(histFrame) 3 -weight 1
2197	grid [listbox $expgui(histFrame).hs.title -height 1 -relief flat \
2198	-font $expgui(histfont) ] -row 0 -column 0 -sticky ew
2199	grid [listbox $expgui(histFrame).hs.lbox -height 10 -width 25 \
2200	-font $expgui(histfont) \
2201	-xscrollcommand "$expgui(histFrame).hs.x set" \
2202	-yscrollcommand "$expgui(histFrame).hs.y set" \
2203	] -row 1 -column 0 -sticky news
2204	lappend expgui(HistSelectList) $expgui(histFrame).hs
2205	grid [scrollbar $expgui(histFrame).hs.x -orient horizontal \
2206	-command "move2boxes \" $expgui(histFrame).hs.title $expgui(histFrame).hs.lbox \" "
2207	] -row 2 -column 0 -sticky ew
2208	grid [scrollbar $expgui(histFrame).hs.y \
2209	-command "$expgui(histFrame).hs.lbox yview"] \
2210	-row 1 -column 1 -sticky ns
2211	grid columnconfigure $expgui(histFrame).hs 0 -weight 1
2212	grid rowconfigure $expgui(histFrame).hs 1 -weight 1
2213	bind $expgui(histFrame).hs.lbox <ButtonRelease-1> {
2214	set expgui(curhist) [$expgui(histFrame).hs.lbox curselection]
2215	DisplayHistogram
2216	}
2217	bind $expgui(histFrame).hs.lbox <Button-3> {
2218	if $expgui(globalmode) {
2219	$expgui(histFrame).hs.lbox selection set 0 end
2220	set expgui(curhist) [$expgui(histFrame).hs.lbox curselection]
2221	DisplayHistogram
2222	}
2223	}
2224
2225
2226	frame $expgui(histFrame).top -borderwidth 4 -relief groove
2227	grid [label $expgui(histFrame).top.txt] -row 0 -column 0
2228	if $expgui(havetix) {
2229	foreach item {scaleBox backBox diffBox} num {1 2 3} \
2230	title {"Scale Factor" Background "Diffractometer Constants"} {
2231	tixLabelFrame $expgui(histFrame).$item \
2232	-borderwidth 4 -width 600 -height 100 -label $title
2233	grid $expgui(histFrame).$item -column 1 -row $num -sticky nsew
2234	set expgui($item) [$expgui(histFrame).$item subwidget frame]
2235	}
2236	} else {
2237	foreach item {scaleBox backBox diffBox} num {0 1 2} \
2238	title {"" Background "Diffractometer Constants"} {
2239	frame $expgui(histFrame).$item -borderwidth 4 -relief groove
2240	grid $expgui(histFrame).$item -column 1 -row $num -sticky nsew
2241	set expgui($item) $expgui(histFrame).$item
2242	if {$title != ""} {
2243	grid [label $expgui(histFrame).$item.title -text $title] \
2244	-row 0 -column 0 -columnspan 10 -sticky nw
2245	}
2246	}
2247	}
2248	grid [label $expgui(scaleBox).histSFLabel -text "Scale Factor"] \
2249	-row 1 -column 6 -sticky nws -padx 2 -pady 3
2250	grid [entry $expgui(scaleBox).ent1 -textvariable entryvar(scale) -width 15] \
2251	-row 1 -column 7 -sticky ew -padx 4 -pady 3
2252	button $expgui(scaleBox).but1 -text "Set Globally" \
2253	-command "editglobalparm histinfo scale {Scale Factor}"
2254
2255	grid [label $expgui(scaleBox).histSFRLabel -text " Refine scale"] \
2256	-row 1 -column 2 -sticky nws -padx 2 -pady 3
2257	grid [checkbutton $expgui(scaleBox).rf -variable entryvar(sref)] \
2258	-row 1 -column 3 -sticky news -padx 4 -pady 3
2259	grid [label $expgui(scaleBox).lD1 -text "Damping"] \
2260	-row 1 -column 4 -sticky w -padx 2 -pady 3
2261	tk_optionMenu $expgui(scaleBox).om entryvar(sdamp) 0 1 2 3 4 5 6 7 8 9
2262	grid $expgui(scaleBox).om \
2263	-row 1 -column 5 -sticky news -padx 4 -pady 3
2264	grid columnconfigure $expgui(scaleBox) 6 -weight 1
2265
2266	# BACKGROUND information.
2267	# <<<<<<<<<<<<<<<<<<<<<<<<< BACKGROUND <<<<<<<<<<<<<<<<<<<<<
2268	grid [ frame $expgui(backBox).f ] -row 0 -column 0 -columnspan 11
2269	grid [ label $expgui(backBox).f.lBGType -textvariable expgui(backtypelbl)] \
2270	-row 1 -column 0 -sticky nws -padx 2 -pady 3
2271	grid [ label $expgui(backBox).f.lBGTerms -textvariable expgui(backtermlbl)] \
2272	-row 1 -column 1 -sticky nws -padx 2 -pady 3
2273	grid [ button $expgui(backBox).f.edit -textvariable expgui(bkglbl) \
2274	-command editbackground] \
2275	-row 1 -column 2 -columnspan 3 -sticky w -padx 2 -pady 3
2276	grid [ frame $expgui(backBox).f1 ] -row 1 -column 0 -columnspan 11 -sticky e
2277	grid [ label $expgui(backBox).f1.lfBG -text " Refine background" ] \
2278	-row 2 -column 1 -sticky news -padx 4 -pady 3
2279	grid [ checkbutton $expgui(backBox).f1.rfBG -text "" \
2280	-variable entryvar(bref) ] \
2281	-row 2 -column 2 -sticky news -padx 4 -pady 3
2282	grid [ label $expgui(backBox).f1.lBGDamp -text Damping ] \
2283	-row 2 -column 3 -sticky w -padx 2 -pady 3
2284	tk_optionMenu $expgui(backBox).f1.om entryvar(bdamp) 0 1 2 3 4 5 6 7 8 9
2285	grid $expgui(backBox).f1.om \
2286	-row 2 -column 4 -sticky news -padx 4 -pady 3 -sticky e
2287
2288	# DIFFRACTOMETER CONSTANTS SECTION
2289
2290	#^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^END OF HISTOGRAM PANE CODE ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^
2291	###############################################################################
2292	#v v v v v v v v v v BEGINNING OF PHASE FRACTION PANE CODE v v v v v v v v v v
2293
2294	pack [frame $expgui(fracFrame).hs] -side left -expand y -fill both
2295	grid [listbox $expgui(fracFrame).hs.title -height 1 -relief flat \
2296	-font $expgui(histfont) ] -row 0 -column 0 -sticky ew
2297	grid [listbox $expgui(fracFrame).hs.lbox -height 10 -width 25 \
2298	-font $expgui(histfont) \
2299	-xscrollcommand "$expgui(fracFrame).hs.x set" \
2300	-yscrollcommand "$expgui(fracFrame).hs.y set" \
2301	] -row 1 -column 0 -sticky news
2302	lappend expgui(HistSelectList) $expgui(fracFrame).hs
2303	grid [scrollbar $expgui(fracFrame).hs.x -orient horizontal \
2304	-command "move2boxes \" $expgui(fracFrame).hs.title $expgui(fracFrame).hs.lbox \" "
2305	] -row 2 -column 0 -sticky ew
2306	grid [scrollbar $expgui(fracFrame).hs.y \
2307	-command "$expgui(fracFrame).hs.lbox yview"] \
2308	-row 1 -column 1 -sticky ns
2309	grid columnconfigure $expgui(fracFrame).hs 0 -weight 1
2310	grid rowconfigure $expgui(fracFrame).hs 1 -weight 1
2311	bind $expgui(fracFrame).hs.lbox <ButtonRelease-1> {
2312	set expgui(curhist) [$expgui(fracFrame).hs.lbox curselection]
2313	DisplayFrac
2314	}
2315	bind $expgui(fracFrame).hs.lbox <Button-3> {
2316	if $expgui(globalmode) {
2317	$expgui(fracFrame).hs.lbox selection set 0 end
2318	set expgui(curhist) [$expgui(fracFrame).hs.lbox curselection]
2319	DisplayFrac
2320	}
2321	}
2322	pack [frame $expgui(fracFrame).f1] -fill both -expand true
2323
2324	# the rest of the page is created in DisplayFrac
2325	# ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ END OF PHASE FRACTION PANE CODE ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^
2326	###############################################################################
2327	# v v v v v v v v v v BEGINNING OF PROFILE PANE CODE v v v v v v v v v v v v v
2328	pack [frame $expgui(profFrame).hs] -side left -expand y -fill both
2329	grid [listbox $expgui(profFrame).hs.title -height 1 -relief flat \
2330	-font $expgui(histfont) ] -row 0 -column 0 -sticky ew
2331	grid [listbox $expgui(profFrame).hs.lbox -height 10 -width 25 \
2332	-font $expgui(histfont) \
2333	-xscrollcommand "$expgui(profFrame).hs.x set" \
2334	-yscrollcommand "$expgui(profFrame).hs.y set" \
2335	] -row 1 -column 0 -sticky news
2336	lappend expgui(HistSelectList) $expgui(profFrame).hs
2337	grid [scrollbar $expgui(profFrame).hs.x -orient horizontal \
2338	-command "move2boxes \" $expgui(profFrame).hs.title $expgui(profFrame).hs.lbox \" "
2339	] -row 2 -column 0 -sticky ew
2340	grid [scrollbar $expgui(profFrame).hs.y \
2341	-command "$expgui(profFrame).hs.lbox yview"] \
2342	-row 1 -column 1 -sticky ns
2343	grid columnconfigure $expgui(profFrame).hs 0 -weight 1
2344	grid rowconfigure $expgui(profFrame).hs 1 -weight 1
2345	bind $expgui(profFrame).hs.lbox <ButtonRelease-1> {
2346	set expgui(curhist) [$expgui(profFrame).hs.lbox curselection]
2347	DisplayProfile
2348	}
2349	bind $expgui(profFrame).hs.lbox <Button-3> {
2350	if $expgui(globalmode) {
2351	$expgui(profFrame).hs.lbox selection set 0 end
2352	set expgui(curhist) [$expgui(profFrame).hs.lbox curselection]
2353	DisplayProfile
2354	}
2355	}
2356
2357	# Create a large canvas area containing a frame for each phase in the data set.
2358	# The canvas and vertical scrollbar are inside a frame called f1
2359	pack [frame $expgui(profFrame).f1] -fill both -expand true
2360	grid [set expgui(ProfileBox) [canvas $expgui(profFrame).f1.profileBox \
2361	-scrollregion {0 0 5000 500} -width 500 -height 350 -bg lightgrey]] \
2362	-sticky news -row 0 -column 0
2363	grid [scrollbar $expgui(profFrame).f1.yscroll -orient vertical] \
2364	-sticky ns -row 0 -column 1
2365
2366	$expgui(ProfileBox) config -yscrollcommand "$expgui(profFrame).f1.yscroll set"
2367	$expgui(profFrame).f1.yscroll config -command { $expgui(ProfileBox) yview }
2368
2369	grid columnconfigure $expgui(profFrame).f1 1 -weight 1
2370	grid rowconfigure $expgui(profFrame).f1 0 -weight 1
2371	frame $expgui(ProfileBox).f -bd 0
2372	$expgui(ProfileBox) create window 0 0 -anchor nw -window $expgui(ProfileBox).f
2373
2374	# ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ END OF PROFILE PANE CODE ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^
2375	##############################################################################
2376	# v v v v v v v v v v BEGINNING OF LS PANE CODE v v v v v v v v v v v v v
2377	array set printopts {
2378	0 "Print the reciprocal metric tensor changes"
2379	1 "Print the correlation matrix"
2380	2 "Print the Least-Squares matrices and vectors"
2381	4 "Print the linear constraint matrices"
2382	5 "Print the applied shifts and shift factors"
2383	6 "Print the reciprocal metric tensor Var-Covar terms"
2384	7 "Print all parameters for each cycle"
2385	8 "Print summary shift/esd data after last cycle"
2386	9 "Print zero/unit pole figure constraint terms"
2387	}
2388	pack [frame $expgui(lsFrame).hs] -side left -expand y -fill both
2389	grid [listbox $expgui(lsFrame).hs.title -height 1 -relief flat \
2390	-font $expgui(histfont) ] -row 0 -column 0 -sticky ew
2391	grid [listbox $expgui(lsFrame).hs.lbox -height 10 -width 25 \
2392	-font $expgui(histfont) \
2393	-xscrollcommand "$expgui(lsFrame).hs.x set" \
2394	-yscrollcommand "$expgui(lsFrame).hs.y set" \
2395	] -row 1 -column 0 -sticky news
2396	lappend expgui(HistSelectList) $expgui(lsFrame).hs
2397	grid [scrollbar $expgui(lsFrame).hs.x -orient horizontal \
2398	-command "move2boxes \" $expgui(lsFrame).hs.title $expgui(lsFrame).hs.lbox \" "
2399	] -row 2 -column 0 -sticky ew
2400	grid [scrollbar $expgui(lsFrame).hs.y \
2401	-command "$expgui(lsFrame).hs.lbox yview"] \
2402	-row 1 -column 1 -sticky ns
2403	grid columnconfigure $expgui(lsFrame).hs 0 -weight 1
2404	grid rowconfigure $expgui(lsFrame).hs 1 -weight 1
2405	bind $expgui(lsFrame).hs.lbox <ButtonRelease-1> {
2406	set expgui(curhist) [$expgui(lsFrame).hs.lbox curselection]
2407	SetupExtractHist
2408	}
2409	bind $expgui(lsFrame).hs.lbox <Button-3> {
2410	if $expgui(globalmode) {
2411	$expgui(lsFrame).hs.lbox selection set 0 end
2412	set expgui(curhist) [$expgui(lsFrame).hs.lbox curselection]
2413	SetupExtractHist
2414	}
2415	}
2416	# need to respond to mouse presses -- control variable associated with extract Fobs
2417	# and set the LeBail extraction flags
2418	proc SetupExtractHist {} {
2419	global expgui entrycmd entryvar expmap
2420
2421	# display the selected histograms
2422	$expgui(lsFrame).hs.lbox selection clear 0 end
2423	foreach h $expgui(curhist) {
2424	$expgui(lsFrame).hs.lbox selection set $h
2425	}
2426	# disable traces on entryvar for right now
2427	set entrycmd(trace) 0
2428
2429	# get histogram list
2430	set histlist {}
2431	foreach item $expgui(curhist) {
2432	lappend histlist [lindex $expmap(powderlist) $item]
2433	}
2434	set entrycmd(fobsextract) "histinfo [list $histlist] foextract"
2435	if {[llength $histlist] == 1} {
2436	set entryvar(fobsextract) [histinfo $histlist foextract]
2437	foreach phase {1 2 3 4 5 6 7 8 9} {
2438	# is the phase present?
2439	if {[lsearch -exact $expmap(phaselist_$histlist) $phase] == -1} {
2440	$expgui(lsFrame).f1.a.l$phase config -fg grey
2441	set expgui(Fextract$phase) {}
2442	# foreach item "a.ca$phase a.cb$phase a.cc$phase"
2443	foreach item "a.ca$phase a.cc$phase" {
2444	$expgui(lsFrame).f1.$item config -state disabled -bd 1
2445	}
2446	} else {
2447	$expgui(lsFrame).f1.a.l$phase config -fg black
2448	# foreach item "a.ca$phase a.cb$phase a.cc$phase"
2449	foreach item "a.ca$phase a.cc$phase" {
2450	$expgui(lsFrame).f1.$item config -state normal -bd 2
2451	}
2452	set expgui(Fextract$phase) [hapinfo $histlist $phase extmeth]
2453	}
2454	}
2455	} else {
2456	# multiple histograms need phases in any histogram
2457	foreach phase {1 2 3 4 5 6 7 8 9} {
2458	set gotphase($phase) 0
2459	}
2460	foreach hist $histlist {
2461	foreach phase $expmap(phaselist_$hist) {
2462	set gotphase($phase) 1
2463	}
2464	}
2465	foreach phase {1 2 3 4 5 6 7 8 9} {
2466	set expgui(Fextract$phase) {}
2467	if $gotphase($phase) {
2468	$expgui(lsFrame).f1.a.l$phase config -fg black
2469	foreach item "a.ca$phase a.cb$phase a.cc$phase" {
2470	$expgui(lsFrame).f1.$item config -state normal -bd 2
2471	}
2472	} else {
2473	$expgui(lsFrame).f1.a.l$phase config -fg grey
2474	foreach item "a.ca$phase a.cb$phase a.cc$phase" {
2475	$expgui(lsFrame).f1.$item config -state disabled -bd 1
2476	}
2477	}
2478	}
2479	}
2480	# reenable traces
2481	set entrycmd(trace) 1
2482	}
2483	# respond to a change in the fobs extraction method for a phase
2484	# force the main extraction flag on, if fobs extraction is selected for any phase
2485	proc HistExtractSet {phase} {
2486	global expgui entryvar expmap
2487	foreach item $expgui(curhist) {
2488	lappend histlist [lindex $expmap(powderlist) $item]
2489	}
2490	hapinfo $histlist $phase extmeth set $expgui(Fextract$phase)
2491	if {$expgui(Fextract$phase) != 0} {set entryvar(fobsextract) 1}
2492	}
2493
2494	pack [frame $expgui(lsFrame).f1] -fill both -expand true
2495	grid rowconfigure $expgui(lsFrame).f1 4 -weight 1
2496	grid [frame $expgui(lsFrame).f1.b -bd 4 -relief groove] -row 0 -column 0
2497	grid [label $expgui(lsFrame).f1.b.lcyc -text "Number of Cycles"] -row 0 -column 0
2498	grid [entry $expgui(lsFrame).f1.b.ecyc -width 3 \
2499	-textvariable entryvar(cycles)] -row 0 -column 1
2500	grid [menubutton $expgui(lsFrame).f1.lprint -textvariable expgui(printopt) \
2501	-menu $expgui(lsFrame).f1.lprint.menu -bd 4 -relief raised \
2502	] -row 0 -column 1
2503	menu $expgui(lsFrame).f1.lprint.menu
2504	foreach num [lsort [array names printopts]] {
2505	$expgui(lsFrame).f1.lprint.menu add checkbutton \
2506	-label "$printopts($num) ([expr int(pow(2,$num))])"\
2507	-variable entryvar(printopt$num)
2508	}
2509	grid [frame $expgui(lsFrame).f1.c -bd 4 -relief groove] -row 0 -column 2
2510	grid [label $expgui(lsFrame).f1.c.fol -text "Extract Fobs"] -row 0 -column 2
2511	grid [checkbutton $expgui(lsFrame).f1.c.foc -variable entryvar(fobsextract)] -row 0 -column 3
2512
2513	grid [frame $expgui(lsFrame).f1.a -bd 4 -relief groove] -row 3 -column 0 -columnspan 6
2514	foreach num {1 2 3 4 5 6 7 8 9} {
2515	grid [label $expgui(lsFrame).f1.a.l$num -text $num] -row 1 -column $num
2516	grid [radiobutton $expgui(lsFrame).f1.a.cc$num \
2517	-command "HistExtractSet $num" \
2518	-variable expgui(Fextract$num) -value 0] \
2519	-row 2 -column $num
2520	grid [radiobutton $expgui(lsFrame).f1.a.ca$num \
2521	-command "HistExtractSet $num" \
2522	-variable expgui(Fextract$num) -value 1] \
2523	-row 3 -column $num
2524	# grid [radiobutton $expgui(lsFrame).f1.a.cb$num \
2525	# -command "HistExtractSet $num" \
2526	# -variable expgui(Fextract$num) -value 2] \
2527	# -row 4 -column $num
2528	}
2529	grid [label $expgui(lsFrame).f1.a.t -text "Intensity Extraction Method" -anchor c] \
2530	-column 0 -columnspan 11 -row 0
2531	grid [label $expgui(lsFrame).f1.a.t0 -text "Histogram #" -anchor c] -column 0 -row 1
2532	grid [label $expgui(lsFrame).f1.a.t1 -text "Rietveld" -anchor c] -column 0 -row 2
2533	grid [label $expgui(lsFrame).f1.a.t2 -text "F(calc) Weighted" -anchor c] -column 0 -row 3
2534	#grid [label $expgui(lsFrame).f1.a.t3 -text "Equally Weighted" -anchor c] -column 0 -row 4
2535	grid [label $expgui(lsFrame).f1.a.t2a -text "(Model biased)" -anchor c] -column 10 -row 3
2536	#grid [label $expgui(lsFrame).f1.a.t3a -text "(Le Bail method)" -anchor c] -column 10 -row 4
2537	# ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ END OF LS PANE CODE ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^ ^
2538	#vvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvvv THE MENU BAR vvvvvvvvvvvvvvvvvvvvvv
2539
2540	#---- file menu button
2541	menubutton $expgui(fm).file -text File -underline 0 -menu $expgui(fm).file.menu
2542	menu $expgui(fm).file.menu
2543	if $expgui(debug) {
2544	$expgui(fm).file.menu add command -label "Reset" -underline 0 \
2545	-command "reset"
2546	}
2547	$expgui(fm).file.menu add checkbutton -label "Archive EXP" -variable expgui(archive) -underline 0
2548	$expgui(fm).file.menu add command -label "Save" -underline 0 \
2549	-command " archiveexp $expfile; set expgui(changed) 0"
2550	$expgui(fm).file.menu add command -label "Save As" -underline 1 \
2551	-command "SaveAsFile"
2552	$expgui(fm).file.menu add command -label "Reread .EXP file" -underline 0 \
2553	-command {rereadexp $expfile}
2554	$expgui(fm).file.menu add command -label "Other .EXP file" -underline 0 \
2555	-command {readnewexp}
2556	#$expgui(fm).file.menu add command -label "Close" -underline 0
2557	$expgui(fm).file.menu add command -label "Exit" -underline 1 -command catchQuit
2558
2559	#---- help menu button
2560	menubutton $expgui(fm).help -text Help -underline 0 -menu $expgui(fm).help.menu
2561	menu $expgui(fm).help.menu
2562	$expgui(fm).help.menu add command -label "About..." -underline 0 -command { About }
2563	#$expgui(fm).help.menu add command -label "GSAStk" -underline 0 -command { GSAStkHelp }
2564
2565	#---- Global mode menu button
2566	menubutton $expgui(fm).edit -text "Global mode" -underline 0 \
2567	-menu $expgui(fm).edit.menu
2568	menu $expgui(fm).edit.menu
2569	$expgui(fm).edit.menu add radiobutton -label "Off" \
2570	-variable expgui(globalmode) -underline 0 -value 0\
2571	-command sethistlist
2572	$expgui(fm).edit.menu add radiobutton -label "All" \
2573	-variable expgui(globalmode) -underline 0 -value 6 \
2574	-command sethistlist
2575	$expgui(fm).edit.menu add radiobutton -label "TOF" \
2576	-variable expgui(globalmode) -underline 0 -value 1 \
2577	-command sethistlist
2578	$expgui(fm).edit.menu add radiobutton -label "CW Neutron" \
2579	-variable expgui(globalmode) -underline 0 -value 2 \
2580	-command sethistlist
2581	$expgui(fm).edit.menu add radiobutton -label "Alpha12 Xray" \
2582	-variable expgui(globalmode) -underline 0 -value 3 \
2583	-command sethistlist
2584	$expgui(fm).edit.menu add radiobutton -label "Monochromatic Xray" \
2585	-variable expgui(globalmode) -underline 0 -value 4 \
2586	-command sethistlist
2587	$expgui(fm).edit.menu add radiobutton -label "Energy Disp Xray" \
2588	-variable expgui(globalmode) -underline 0 -value 5 \
2589	-command sethistlist
2590	set expgui(globalmode) 0
2591	#---- options menu button
2592	menubutton $expgui(fm).atom -text Options -underline 0 \
2593	-menu $expgui(fm).atom.menu
2594	menu $expgui(fm).atom.menu
2595	$expgui(fm).atom.menu add cascade -menu $expgui(fm).atom.menu.asort \
2596	-label "Sort atoms by"
2597
2598	set expgui(asorttype) number
2599	menu $expgui(fm).atom.menu.asort
2600	$expgui(fm).atom.menu.asort add radiobutton -command DisplayAllAtoms \
2601	-label number -value number -variable expgui(asorttype)
2602	$expgui(fm).atom.menu.asort add radiobutton -command DisplayAllAtoms \
2603	-label type -value type -variable expgui(asorttype)
2604	$expgui(fm).atom.menu.asort add radiobutton -command DisplayAllAtoms \
2605	-label x -value x -variable expgui(asorttype)
2606	$expgui(fm).atom.menu.asort add radiobutton -command DisplayAllAtoms \
2607	-label y -value y -variable expgui(asorttype)
2608	$expgui(fm).atom.menu.asort add radiobutton -command DisplayAllAtoms \
2609	-label z -value z -variable expgui(asorttype)
2610
2611
2612	$expgui(fm).atom.menu add cascade -menu $expgui(fm).atom.menu.hsort \
2613	-label "Sort histograms by"
2614
2615	set expgui(hsorttype) number
2616	menu $expgui(fm).atom.menu.hsort
2617	$expgui(fm).atom.menu.hsort add radiobutton -command sethistlist \
2618	-label number -value number -variable expgui(hsorttype)
2619	$expgui(fm).atom.menu.hsort add radiobutton -command sethistlist \
2620	-label "Histogram type" -value type -variable expgui(hsorttype)
2621	$expgui(fm).atom.menu.hsort add radiobutton -command sethistlist \
2622	-label "Bank #" -value bank -variable expgui(hsorttype)
2623	$expgui(fm).atom.menu.hsort add radiobutton -command sethistlist \
2624	-label "Angle/Wavelength" -value angle -variable expgui(hsorttype)
2625
2626	pack $expgui(fm).file $expgui(fm).edit $expgui(fm).atom \
2627	-side left -in $expgui(fm)
2628	pack $expgui(fm).help -side right -in $expgui(fm)
2629
2630	#^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^ END OF MENU DEFINITION ^^^^^^^^^^^^^^^^^^^
2631
2632	# handle indirect exits
2633	wm protocol . WM_DELETE_WINDOW catchQuit
2634	bind . <Control-c> catchQuit
2635
2636	loadexp $expfile

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