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source: trunk/expgui @ 10

Last change on this file since 10 was 10, checked in by toby, 14 years ago
# on 1998/12/26 22:03:11, toby did: Initial revision
Property rcs:author set to `toby` Property rcs:date set to `1998/12/26 22:03:11` Property rcs:rev set to `1.1` Property rcs:state set to `Exp` Property svn:keywords set to `Author Date Revision Id`
File size: 95.5 KB

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

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