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/*******************************************************************************
* *
* Viewmol *
* *
* C E L L F O R M . C *
* *
* Copyright (c) Joerg-R. Hill, October 2003 *
* *
********************************************************************************
*
* $Id: cellform.c,v 1.5 2004/08/29 14:49:02 jrh Exp $
* $Log: cellform.c,v $
* Revision 1.5 2004/08/29 14:49:02 jrh
* Release 2.4.1
*
* Revision 1.4 2003/11/07 10:58:46 jrh
* Release 2.4
*
* Revision 1.3 2000/12/10 15:02:51 jrh
* Release 2.3
*
* Revision 1.2 1999/05/24 01:24:56 jrh
* Release 2.2.1
*
* Revision 1.1 1999/02/07 21:45:28 jrh
* Initial revision
*
*/
#include<math.h>
#include<stdio.h>
#include<X11/Intrinsic.h>
#include<Xm/Xm.h>
#include<Xm/BulletinB.h>
#include<Xm/Form.h>
#include<Xm/Label.h>
#include<Xm/LabelG.h>
#include<Xm/PanedW.h>
#include<Xm/PushB.h>
#include<Xm/PushBG.h>
#include<Xm/RowColumn.h>
#include<Xm/Scale.h>
#include<Xm/Separator.h>
#include<Xm/Text.h>
#include<Xm/ToggleB.h>
#include "viewmol.h"
#include "dialog.h"
void unitcellExit(Widget, caddr_t, XmPushButtonCallbackStruct *);
void setCellSliders(struct MOLECULE *);
void makeNewCell(Widget, struct SLIDER *, XmScrollBarCallbackStruct *);
void makeMillerPlane(Widget, struct SLIDER *, XmScrollBarCallbackStruct *);
extern void GetSlider(Widget, struct SLIDER *, XmScrollBarCallbackStruct *);
extern void drawMolecule(Widget, caddr_t, XmDrawingAreaCallbackStruct *);
extern int redraw(int);
extern void expandCell(int, int);
extern void millerPlane(void);
extern void MapBox(Widget, caddr_t, XmToggleButtonCallbackStruct *);
extern Widget CreatePushButtonRow(Widget, struct PushButtonRow *, int);
extern Widget CreateToggleBox(Widget, struct PushButtonRow *, int, int,
int, int, int);
extern void changeBoolean(Widget, int *, XmDrawingAreaCallbackStruct *);
extern Widget initShell(Widget, char *, Widget *, Widget *);
extern void setMenuItem(int, int);
extern void *getmem(size_t, size_t);
extern void fremem(void **);
extern struct WINDOW windows[];
extern struct MOLECULE *molecules;
extern Widget topShell;
extern int showUnitCell, iwavef;
static Widget dialog, millerButton, cellWidgets[3], millerWidgets[3];
static struct MOLECULE *mol;
static int showUnitCell_save, showMiller_save;
static int miller_save[3];
static double cellFactor_save[3], miller[3];
void unitcellDialog(Widget widget, caddr_t dummy, XmAnyCallbackStruct *data)
{
Widget form, form1, board, togglebox, sep;
short decimals;
static struct SLIDER cellSliders[3], millerSliders[3];
static struct PushButtonRow checkbox_button[] = {{"visible", changeBoolean,
(XtPointer)&showUnitCell, NULL},
{"miller", changeBoolean,
(XtPointer)NULL, NULL}};
static struct PushButtonRow buttons[] = {
{ "ok", unitcellExit, (XtPointer)TRUE, NULL },
{ "cancel", unitcellExit, (XtPointer)FALSE, NULL },
};
char line[]=" value";
register int i;
/* This function creates the dialog for the "Unit cell" option */
millerPlane();
if (windows[VIEWER].set < 0)
mol=&molecules[0];
else
mol=&molecules[windows[VIEWER].set];
setMenuItem(VIEWER_UNITCELL, False);
showUnitCell_save=showUnitCell;
showMiller_save=mol->unitcell->showMiller;
cellFactor_save[0]=mol->unitcell->factor[0];
cellFactor_save[1]=mol->unitcell->factor[1];
cellFactor_save[2]=mol->unitcell->factor[2];
miller_save[0]=mol->unitcell->miller[0];
miller_save[1]=mol->unitcell->miller[1];
miller_save[2]=mol->unitcell->miller[2];
dialog=initShell(windows[VIEWER].widget, "unitcellForm", &board,
&form);
checkbox_button[1].client_data=(XtPointer)&(mol->unitcell->showMiller);
togglebox=CreateToggleBox(form, checkbox_button, XtNumber(checkbox_button),
XmHORIZONTAL, 1, False, ((mol->unitcell->showMiller << 1) | showUnitCell));
millerButton=checkbox_button[1].widget;
sep=XtVaCreateManagedWidget("sep", xmSeparatorWidgetClass, form,
NULL);
form1=XtVaCreateWidget("rowcolumn", xmRowColumnWidgetClass, form,
XmNorientation, XmHORIZONTAL,
XmNpacking, XmPACK_COLUMN,
XmNnumColumns, (short)3,
NULL);
for (i=0; i<3; i++)
{
line[0]=(char)(97+i);
cellWidgets[i]=XtVaCreateManagedWidget(line, xmScaleWidgetClass, form1,
XmNorientation, XmHORIZONTAL,
XmNshowValue, True,
XmNsensitive, True,
NULL);
XtVaGetValues(cellWidgets[i], XmNdecimalPoints, &decimals, NULL);
XtVaSetValues(cellWidgets[i], XmNvalue, (int)(mol->unitcell->factor[i]*pow(10.0,
(double)decimals)), NULL);
cellSliders[i].number=&(mol->unitcell->factor[i]);
cellSliders[i].decimals=decimals;
cellSliders[i].draw=(void (*)())drawMolecule;
XtAddCallback(cellWidgets[i], XmNvalueChangedCallback, (XtCallbackProc)makeNewCell,
&cellSliders[i]);
line[0]=(char)(104+i);
if (i > 0) line[0]+=2;
millerWidgets[i]=XtVaCreateManagedWidget(line, xmScaleWidgetClass, form1,
XmNorientation, XmHORIZONTAL,
XmNshowValue, True,
XmNsensitive, True,
XmNdecimalPoints, 0,
XmNvalue, mol->unitcell->miller[i],
NULL);
miller[i]=(double)(mol->unitcell->miller[i]);
millerSliders[i].number=&miller[i];
millerSliders[i].decimals=0;
millerSliders[i].draw=(void (*)())drawMolecule;
XtAddCallback(millerWidgets[i], XmNvalueChangedCallback, (XtCallbackProc)makeMillerPlane,
&millerSliders[i]);
}
XtManageChild(form1);
sep=XtVaCreateManagedWidget("sep", xmSeparatorWidgetClass, form,
NULL);
CreatePushButtonRow(form, buttons, XtNumber(buttons));
XtAddCallback(dialog, XmNpopupCallback, (XtCallbackProc)MapBox,
(XmAnyCallbackStruct *)NULL);
XtManageChild(form);
XtManageChild(board);
}
void unitcellExit(Widget button, caddr_t which,
XmPushButtonCallbackStruct *data)
{
XtDestroyWidget(dialog);
dialog=NULL;
if (!(int)which)
{
showUnitCell=showUnitCell_save;
mol->unitcell->showMiller=showMiller_save;
if (mol->unitcell->factor[0] != cellFactor_save[0] ||
mol->unitcell->factor[1] != cellFactor_save[1] ||
mol->unitcell->factor[2] != cellFactor_save[2])
{
mol->unitcell->factor[0]=cellFactor_save[0];
mol->unitcell->factor[1]=cellFactor_save[1];
mol->unitcell->factor[2]=cellFactor_save[2];
expandCell(TRUE, TRUE);
}
mol->unitcell->miller[0]=miller_save[0];
mol->unitcell->miller[1]=miller_save[1];
mol->unitcell->miller[2]=miller_save[2];
redraw(VIEWER);
}
setMenuItem(VIEWER_UNITCELL, True);
}
void setCellSliders(struct MOLECULE *mol)
{
short decimals;
register int i;
if (dialog)
{
for (i=0; i<3; i++)
{
XtVaGetValues(cellWidgets[i], XmNdecimalPoints, &decimals, NULL);
XtVaSetValues(cellWidgets[i], XmNvalue, (int)(mol->unitcell->factor[i]*pow(10.0,
(double)decimals)), NULL);
}
}
}
void makeNewCell(Widget w, struct SLIDER *slider, XmScrollBarCallbackStruct *data)
{
GetSlider(w, slider, data);
expandCell(TRUE, TRUE);
redraw(VIEWER);
}
void makeMillerPlane(Widget w, struct SLIDER *slider, XmScrollBarCallbackStruct *data)
{
static int save=(-1);
GetSlider(w, slider, data);
mol->unitcell->miller[0]=(int)(miller[0]);
mol->unitcell->miller[1]=(int)(miller[1]);
mol->unitcell->miller[2]=(int)(miller[2]);
if (mol->unitcell->miller[0] == 0 && mol->unitcell->miller[1] == 0 && mol->unitcell->miller[2] == 0)
{
save=mol->unitcell->showMiller;
mol->unitcell->showMiller=FALSE;
XtVaSetValues(millerButton, XmNsensitive, False,
XmNset, False,
NULL);
}
else
{
if (save != -1) mol->unitcell->showMiller=save;
XtVaSetValues(millerButton, XmNsensitive, True, NULL);
if (save == TRUE)
XtVaSetValues(millerButton, XmNset, True, NULL);
if (mol->unitcell->miller[0] != miller_save[0] || mol->unitcell->miller[1] != miller_save[1] ||
mol->unitcell->miller[2] != miller_save[2]) millerPlane();
}
redraw(VIEWER);
}
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