Global variable declarations
Global convenience function declarations
Global data structure definitions. More...

#include <glib.h>
#include <glib/gi18n.h>
#include <locale.h>
#include <unistd.h>
#include <string.h>
#include <stdio.h>
#include <stdlib.h>
#include <sys/types.h>
#include <sys/stat.h>
#include <math.h>
#include <gtk/gtk.h>
#include <gtk/gtkx.h>
#include <gdk/gdk.h>
#include <gdk/gdkkeysyms.h>
#include <gdk-pixbuf/gdk-pixbuf.h>
#include <pango/pangoft2.h>
#include <epoxy/gl.h>
#include <GL/glu.h>
#include <epoxy/glx.h>
#include "math_3d.h"
#include "glwin.h"

Include dependency graph for global.h:

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Data Structures
struct	dint

struct	tint

struct	qint

struct	ColRGBA

struct	shortcuts

struct	atomes_action

struct	coord_info

struct	line_node

struct	coord_file

struct	MouseState

struct	CurveState

struct	DataLayout

struct	CurveExtra

struct	ExtraSets

struct	Curve

struct	classical_field

struct	thermostat

struct	dummy_atom

struct	cpmd

struct	cp2k

struct	molecule

struct	model

struct	element_data

struct	chemical_data

struct	insertion_menu

struct	atom

struct	project

struct	workspace

struct	focus_data

Macros
#define	GDK_SYNCHRONIZE

#define	GLOBAL_H_

#define	max(a, b) (a>=b?a:b)

#define	min(a, b) (a<=b?a:b)

#define	MEDIA_NEXT "media-skip-forward"

#define	MEDIA_PREV "media-skip-backward"

#define	MEDIA_LAST "go-last"

#define	MEDIA_FIRST "go-first"

#define	MEDIA_GOTO "go-jump"

#define	MEDIA_PLAY "media-playback-start"

#define	MEDIA_STOP "media-playback-stop"

#define	MEDIA_LOOP "view-refresh"

#define	MEDIA_ULOOP "edit-cut"

#define	MEDIA_SLOW "view-sort-ascending"

#define	MEDIA_FAST "view-sort-descending"

#define	GO_RIGHT "go-next"

#define	GO_LEFT "go-previous"

#define	GO_UP "go-up"

#define	GO_DOWN "go-down"

#define	PAGE_SETUP "document-page-setup"

#define	FULLSCREEN "view-fullscreen"

#define	FITBEST "zoom-fit-best"

#define	RECORD "media-record"

#define	YES "gtk-yes"

#define	EDITA "edit-find-replace"

#define	EDITC "edit-copy"

#define	EDITF "edit-find"

#define	ECUT "edit-cut"

#define	DPROPERTIES "document-properties"

#define	FNEW "document-new"

#define	FOPEN "document-open"

#define	FSAVE "document-save"

#define	FSAVEAS "document-save-as"

#define	FCLOSE "window-close"

#define	FEXIT "application-exit"

#define	LIST_ADD "list-add"

#define	LIST_REM "list-remove"

#define	CANCEL "process-stop"

#define	EXECUTE "system-run"

#define	APPLY "gtk-apply"

#define	DELETEB "edit-delete"

#define	DIAL_ERROR "dialog-error"

#define	AFILE "text-x-generic"

#define	ABOUT "help-about"

#define	BSEP 0

#define	IODEBUG FALSE

#define	ATOM_LIMIT 100000
	atom number limit to compute fragment(s) and molecule(s) analysis automatically

#define	STEP_LIMIT 10000

#define	OK 0

#define	ERROR_RW 1

#define	ERROR_PROJECT 2

#define	ERROR_CURVE 3

#define	ERROR_IMAGE 4

#define	ERROR_ATOM_A 5

#define	ERROR_ATOM_B 6

#define	ERROR_UPDATE 7

#define	ERROR_NO_WAY 8

#define	ERROR_COORD 9

#define	ERROR_RINGS 10

#define	ERROR_CHAINS 11

#define	ERROR_MOL 12

#define	CHEM_PARAMS 5

#define	CHEM_Z 0

#define	CHEM_M 1

#define	CHEM_R 2

#define	CHEM_N 3

#define	CHEM_X 4

#define	NDOTS 8

#define	NCALCS 12

#define	NGRAPHS 10

#define	NCFORMATS 12

#define	NITEMS 16

#define	OT 4

#define	GR 0

#define	SQ 1

#define	SK 2

#define	GK 3

#define	BD 4

#define	AN 5

#define	RI 6

#define	CH 7

#define	SP 8

#define	MS 9

#define	BV 10

#define	FF 12

#define	DEFAULT_FONT_SIZE 8

#define	DEFAULT_ALPHA 0.75

#define	MINCUT 1.85

#define	LINE_SIZE 160

#define	MAXDATC 8
	Number of tabs for the description of the classical calculation.

#define	MAXDATA 21
	Number of tabs for the description of the classical force field.

Typedefs
typedef struct dint	dint

typedef struct tint	tint

typedef struct qint	qint

typedef struct ColRGBA	ColRGBA

typedef struct shortcuts	shortcuts
	keyboard shortcuts information

typedef struct atomes_action	atomes_action
	action information data structure

typedef struct coord_info	coord_info
	coordination information data structure

typedef struct line_node	line_node

typedef struct coord_file	coord_file
	atomic coordinates file, data container

typedef struct MouseState	MouseState
	data structure to store mouse information on curve widget

typedef struct CurveState	CurveState
	data structure used for zoom in / out on curve widget

typedef struct DataLayout	DataLayout
	curve layout information

typedef struct CurveExtra	CurveExtra
	extra curve(s) data information

typedef struct ExtraSets	ExtraSets
	list of extra data sets for a curve

typedef struct Curve	Curve
	curve data structure

typedef struct classical_field	classical_field

typedef struct thermostat	thermostat

typedef struct dummy_atom	dummy_atom

typedef struct cpmd	cpmd

typedef struct cp2k	cp2k

typedef struct molecule	molecule
	the molecule data structure

typedef struct model	model
	data structure to describe the topology

typedef struct element_data	element_data
	element description used for the periodic table defined in 'w_periodic.c'

typedef struct chemical_data	chemical_data
	a structure to store some chemical information

typedef struct insertion_menu	insertion_menu
	data structure for the insertion pop-up menu

typedef struct atom	atom
	atom data structure

typedef struct project	project
	data structure for the 'atomes' project

typedef struct workspace	workspace
	data structure for the 'atomes' workspace

Enumerations
enum	ContainerType { CONTAINER_WIN = 0 , CONTAINER_SCR = 1 , CONTAINER_VIE = 2 , CONTAINER_BUT = 3 , CONTAINER_FRA = 4 , CONTAINER_EXP = 5 }

enum	ImageFormats { IMG_NONE = 0 , IMG_PIXBUF = 1 , IMG_SURFACE = 2 , IMG_FILE = 3 , IMG_STOCK = 4 }

Functions
void	add_action (GSimpleAction *action)
	add action to the main window action map

void	remove_action (gchar *action_name)
	add action from the main window action map

void	remove_edition_actions ()
	remove all edition actions

void	remove_edition_and_analyze_actions ()
	remove all edition and analysis action

project *	get_project_by_id (int p)
	get project pointer using id number

void	opengl_project_changed (int id)
	change the OpenGL project

gboolean	in_md_shaders (project *this_proj, int id)
	is this shader MD dependent ?

void	recreate_all_shaders (glwin *view)
	re-initialize all OpenGL shaders

gboolean	is_atom_win_active (glwin *view)
	is the model edition window visible ?

G_MODULE_EXPORT void	on_calc_bonds_released (GtkWidget *widg, gpointer data)
	compute bonding properties

void	update_rings_menus (glwin *view)

void	clean_rings_data (int rid, glwin *view)
	clean a ring type data for a glview

void	clean_chains_data (glwin *view)
	cleaning the OpenGL data related to chain statistics

void	clean_volumes_data (glwin *view)
	clean volume data

void	initcutoffs (chemical_data *chem, int species)
	initialize bond cutoffs

void	cutoffsend ()
	send cutoffs to Fortran90

void	update_entry_int (GtkEntry *entry, int intval)
	update the content of a GtkEntry as int

void	update_entry_double (GtkEntry *entry, double doubleval)
	update the content of a GtkEntry as double

void	update_entry_long_double (GtkEntry *entry, double doubleval)
	update the content of a GtkEntry as long double

void	update_entry_text (GtkEntry entry, gchar text)
	update the content of a GtkEntry as string

gboolean *	allocbool (int val)
	allocate a gboolean * pointer

gboolean **	allocdbool (int xal, int yal)
	allocate a gboolean ** pointer

gboolean ***	alloctbool (int xal, int yal, int zal)
	allocate a gboolean *** pointer

int *	allocint (int val)
	allocate an int * pointer

int **	allocdint (int xal, int yal)
	allocate an int ** pointer

int ***	alloctint (int xal, int yal, int zal)
	allocate an int *** pointer

int ****	allocqint (int wal, int xal, int yal, int zal)
	allocate an int **** pointer

float *	allocfloat (int val)
	allocate a float * pointer

float **	allocdfloat (int xal, int yal)
	allocate a float ** pointer

float ***	alloctfloat (int xal, int yal, int zal)
	allocate a float *** pointer

double *	allocdouble (int val)
	allocate a double * pointer

double **	allocddouble (int xal, int yal)
	allocate a double ** pointer

double ***	alloctdouble (int xal, int yal, int zal)
	allocate a double *** pointer

double ****	allocqdouble (int wal, int xal, int yal, int zal)
	allocate a double **** pointer

GLuint *	allocgluint (int val)
	allocate a GLuint * pointer

GLuint **	allocdgluint (int xal, int yal)
	allocate a GLuint ** pointer

GLfloat **	allocdGLfloat (int xal, int yal)
	allocate a GLfloat ** pointer

gchar **	duplicate_strings (int num, gchar **old_val)
	copy a list of strings

int *	duplicate_int (int num, int *old_val)
	copy a list of int

gboolean *	duplicate_bool (int num, gboolean *old_val)
	copy a list of gboolean

float *	duplicate_float (int num, float *old_val)
	copy a list of float

double *	duplicate_double (int num, double *old_val)
	copy a list of double

ColRGBA *	duplicate_color (int num, ColRGBA *col)
	duplicate a ColRGBA pointer

void	combo_text_append (GtkWidget combo, gchar text)
	append text in GtkComboBox widget

void	combo_text_prepend (GtkWidget combo, gchar text)
	prepend text in GtkComboBox widget

GtkWidget *	create_combo ()
	create a GtkCombox widget, note deprecated in GTK4

GtkTextBuffer *	add_buffer (GCallback handler, gpointer data, gchar *text)
	create a GtkTextBuffer

GtkWidget *	create_text_view (int dimx, int dimy, int edit, int mono, GCallback handler, gpointer data, gchar *text)
	create a GtkTextView and display some text

GdkPixbuf *	convert_to_pixbuf (cairo_surface_t *surf)
	convert cairo surface to GdkPixbuf

void	text_view_set_monospace (GtkWidget *view)
	set the font of a GtkTextView as monospace

void	gtk_label_align (GtkWidget *lab, float ax, float ay)
	set text alignment in a GtkLabel

gchar *	prepare_for_title (gchar *init)
	prepare a string for a window title, getting rid of all markup

void	show_the_widgets (GtkWidget *widg)
	show GtkWidget

void	hide_the_widgets (GtkWidget *widg)
	hide GtkWidget

gboolean	is_the_widget_visible (GtkWidget *widg)
	test if a GtkWidget exist, then return if it is visible or not

void	widget_set_sensitive (GtkWidget *widg, gboolean sensitive)
	Set sensitivity for a GtkWidget, ensuring it is a GtkWidget.

GtkWidget *	new_gtk_window ()
	create a new GtkWindow

GtkWidget *	dialogmodal (gchar str, GtkWindow parent)
	Create a new dialog modal window.

GtkWidget *	message_dialogmodal (gchar message, gchar title, GtkMessageType mtype, GtkButtonsType buttons, GtkWidget *parent)
	create a modal (cannot be ignored) message window

GtkWidget *	dialog_cancel_apply (gchar title, GtkWidget parent, gboolean resiz)
	create a dialog modal offering a choice to apply something or not

void	run_this_gtk_dialog (GtkWidget *dial, GCallback handler, gpointer data)
	run a GTK (3 and 4) basic GtkDialog

void	resize_this_window (GtkWidget *window, int x, int y)
	resize this GtkWindow

GtkWidget *	create_hscale (float min, float max, float delta, float val, int pos, int round, int size, GCallback handler, GCallback scroll_handler, gpointer data)
	create an horizontal scale GtkWidget

GtkWidget *	create_vscale (float min, float max, float delta, float val, int pos, int round, int size, GCallback handler, GCallback scroll_handler, gpointer data)
	create an vertical scale GtkWidget

void	add_container_child (int type, GtkWidget widg, GtkWidget child)
	Add a GtkWidget into another GtkWidget.

void	add_box_child_end (GtkWidget widg, GtkWidget child, gboolean expand, gboolean fill, int padding)
	Add a GtkWidget in a GtkBox at the end position.

void	add_box_child_start (int orientation, GtkWidget widg, GtkWidget child, gboolean expand, gboolean fill, int padding)
	Add a GtkWidget in a GtkBox at the initial position.

GtkWidget *	create_vbox (int spacing)
	create a GtkBox with vertical orientation

GtkWidget *	create_hbox (int spacing)
	create a GtkBox with horizontal orientation

GtkWidget *	dialog_get_content_area (GtkWidget *widg)
	prepare GtkWidget to insert content in a GtkDialog window

void	layout_add_widget (GtkWidget layout, GtkWidget child, int x_pos, int y_pos)
	Add a GtkWidget in a GtkLayout.

GtkWidget *	add_vbox_to_layout (GtkWidget *layout, int size_x, int size_y)
	Insert a vertical GtkBox in a GtkLatout then send back the GtkBox.

GtkWidget *	create_layout (int x, int y)
	create a GtkLayout / GtkFixed widget

void	update_chains_menus (glwin *view)

G_MODULE_EXPORT void	select_unselect_this_atom (GtkWidget *widg, gpointer data)
	select / unselect this atom callback GTK3

G_MODULE_EXPORT void	select_unselect_atoms (GtkWidget *widg, gpointer data)
	select / unselect a type of atom(s) callback GTK3

G_MODULE_EXPORT void	select_unselect_coord (GtkWidget *widg, gpointer data)
	select / unselect a type of coordination callback GTK3

G_MODULE_EXPORT void	label_unlabel_this_atom (GtkWidget *widg, gpointer data)
	label / unlabel this atom callback GTK3

G_MODULE_EXPORT void	label_unlabel_atoms (GtkWidget *widg, gpointer data)
	label / unlabel a type of atom(s) callback GTK3

G_MODULE_EXPORT void	label_unlabel_coord (GtkWidget *widg, gpointer data)
	label / unlabel a type of coordination callback GTK3

G_MODULE_EXPORT void	show_hide_this_atom (GtkWidget *widg, gpointer data)
	show / hide this atom callback GTK3

G_MODULE_EXPORT void	show_hide_atoms (GtkWidget *widg, gpointer data)

G_MODULE_EXPORT void	show_hide_the_coord (GtkWidget *widg, gpointer data)
	show / hide a type of coordination callback GTK3

G_MODULE_EXPORT void	show_hide_coord (GtkWidget *widg, gpointer data)
	show/hide coordination callback GTK3

G_MODULE_EXPORT void	show_hide_poly (GtkWidget *widg, gpointer data)
	show / hide polyhedra callback - GTK3

G_MODULE_EXPORT void	show_hide_labels (GtkWidget *widg, gpointer data)

G_MODULE_EXPORT void	remove_the_atoms (GtkWidget *widg, gpointer data)
	remove selected atom(s) callback GTK3

G_MODULE_EXPORT void	replace_the_atoms (GtkWidget *widg, gpointer data)
	replace selected atom(s) callback GTK3

G_MODULE_EXPORT void	edit_in_new_project (GtkWidget *widg, gpointer data)
	create new project using selection callback GTK3

GtkWidget *	create_menu_item (gboolean add_mnemo, gchar *action)

GtkWidget *	create_menu_item_from_widget (GtkWidget *widg, gboolean check, gboolean radio, gboolean status)

GtkWidget *	menu_item_new_with_submenu (gchar name, gboolean active, GtkWidget sub_menu)

void	add_menu_separator (GtkWidget *menu)

G_MODULE_EXPORT gboolean	destroy_this_window (GtkWidget win, GdkEvent event, gpointer data)
	destroy a GtkWindow

G_MODULE_EXPORT gboolean	hide_this_window (GtkWidget win, GdkEvent event, gpointer data)
	hide a GtkWindow

GtkWidget *	create_file_chooser (const gchar title, GtkWindow parent, GtkFileChooserAction act, const gchar *act_name)
	create a GtkFileChooser, utility to select file(s)

void	pop_menu_at_pointer (GtkWidget widg, GdkEvent event)
	popup a menu at pointer location

GSList *	file_chooser_get_file_names (GtkFileChooser *chooser)
	create a file list from files selected using a GtkFileChooser

const gchar *	entry_get_text (GtkEntry *entry)
	get the text in a GtkEntry

GtkWidget *	create_entry (GCallback handler, int dim, int cdim, gboolean key_release, gpointer data)
	Create a GtkEntry.

GtkWidget *	stock_image (const gchar *stock_id)
	create a GtkImage for the Gtk database

void	set_image_from_icon_name (GtkWidget widg, gchar icon)
	set a image from a stock icon name

GtkWidget *	create_image_from_data (int format, gpointer item_image)
	create Gtk image for data

GtkWidget *	gtk3_menu_item (GtkWidget menu, gchar name, int icon_format, gpointer item_icon, GCallback handler, gpointer data, gboolean accel, guint key, GdkModifierType mod, gboolean check, gboolean radio, gboolean status)

GtkWidget *	add_advanced_item (GtkWidget *menu, GCallback handler, gpointer data, gboolean accel, guint key, GdkModifierType mod)

GtkWidget *	markup_label (gchar *text, int dimx, int dimy, float ax, float ay)

GtkWidget *	color_button (ColRGBA col, gboolean alpha, int dimx, int dimy, GCallback handler, gpointer data)
	create a color selection button

GtkWidget *	font_button (gchar *font, int dimx, int dimy, GCallback handler, gpointer data)
	create a font selection button

GtkWidget *	spin_button (GCallback handler, double value, double start, double end, double step, int digits, int dim, gpointer data)
	create a spin button

GtkWidget *	check_button (gchar *text, int dimx, int dimy, gboolean state, GCallback handler, gpointer data)
	create a check button

GtkWidget *	radio_button (gchar *text, int dimx, int dimy, gboolean state, GCallback handler, gpointer data)
	create a radio button

GtkWidget *	create_button (gchar text, int image_format, gchar image, int dimx, int dimy, int relief, GCallback handler, gpointer data)
	create a simple button

ColRGBA	gdkrgba_to_rgba (GdkRGBA colgdk)
	convert GdkRGBA color to ColRGBA color

GdkRGBA	colrgba_togtkrgba (ColRGBA col)
	convert ColRGBA color to GdkRGBA color

ColRGBA	get_button_color (GtkColorChooser *colob)
	get the ColRGBA color from a GtkColorChooser button

ColRGBA	get_window_color (GtkWidget *color_win)
	get the ColRGBA color from a color selection window

void	set_color_chooser_color (GtkWidget *color_win, ColRGBA col)
	set the color of a color selection window

void	set_renderer_color (int tocol, GtkCellRenderer *renderer, ColRGBA col)
	set the color of a GtkCellRenderer

void	button_set_image (GtkButton but, gchar text, int format, gpointer image)
	Add an image to a GtkButton.

GtkWidget *	abox (GtkWidget box, char lab, int vspace)
	box creating routine, to help design faster elements for the GUI

GtkWidget *	bbox (GtkWidget box, char lab)

GtkWidget *	cbox (GtkWidget box, char lab)

GtkWidget *	fbox (GtkWidget box, char lab)

GtkWidget *	create_scroll (GtkWidget *box, int dimx, int dimy, int shadow)
	create a scroll window

GtkWidget *	create_expander (gchar name, gchar file_img)
	create GtkExpander

GtkWidget *	create_win (gchar str, GtkWidget parent, gboolean modal, gboolean resiz)
	create a new GtkWindow

void	widget_add_action (GSimpleActionGroup action_group, const gchar act, GCallback handler, gpointer data, gboolean check, gboolean status, gboolean radio, const gchar *stat)
	add an action to an action group

void	append_menu_item (GMenu menu, const gchar label, const gchar action, const gchar accel, const gchar custom, int format, const gchar icon, gboolean check, gboolean status, gboolean radio, const gchar *rstatus)
	create a menu item, then append it to a menu

void	append_submenu (GMenu menu, const gchar label, GMenu *submenu)
	append a GMenuItem with a subenu to a GMenu, and use markup for the GMenuItem

GtkWidget *	destroy_this_widget (GtkWidget *widg)
	destroy a GtkWidget

void	destroy_this_dialog (GtkDialog *dialog)
	destroy a GtkDialog

void	destroy_this_native_dialog (GtkNativeDialog *dialog)
	destroy a GtkNativeDialog

G_MODULE_EXPORT void	run_destroy_dialog (GtkDialog *dialog, gint response_id, gpointer data)
	to destroy a GtkDialog when the dialog emit the closing signal

void	add_gtk_close_event (GtkWidget *widg, GCallback handler, gpointer data)
	add a close event signal and callback to a GtkWidget

gchar *	file_chooser_get_file_name (GtkFileChooser *chooser)
	get a file name from a GtkFileChooser (single file selected)

gchar *	file_chooser_get_current_folder (GtkFileChooser *chooser)
	get the current folder for a GtkFileChooser

gboolean	file_chooser_set_file_name (GtkFileChooser chooser, gchar filename)
	set file name in a GtkFilechooser

void	file_chooser_set_current_folder (GtkFileChooser *chooser)
	set current folder in a GtkFilechooser

GtkWidget *	get_top_level (GtkWidget *widg)
	get the top level container, window, of a widget

void	provide_gtk_css (gchar *css)
	create a css provider based on the css data

double	string_to_double (gpointer string)
	convert string to double

double	get_calc_time (struct timespec start, struct timespec stop)
	get calculation time in s

gchar *	calculation_time (gboolean modelv, double ctime)
	get calculation time, human readable

int	get_widget_width (GtkWidget *widg)
	retrive GtkWidget width

int	get_widget_height (GtkWidget *widg)
	retrive GtkWidget height

Variables
gchar *	PACKAGE_LIB_DIR

gchar *	PACKAGE_IMP

gchar *	PACKAGE_CON

gchar *	PACKAGE_IMG

gchar *	PACKAGE_PDF

gchar *	PACKAGE_SVG

gchar *	PACKAGE_EPS

gchar *	PACKAGE_PNG

gchar *	PACKAGE_JPG

gchar *	PACKAGE_BMP

gchar *	PACKAGE_TIFF

gchar *	PACKAGE_VOID

gchar *	PACKAGE_GR

gchar *	PACKAGE_SQ

gchar *	PACKAGE_BD

gchar *	PACKAGE_AN

gchar *	PACKAGE_RI

gchar *	PACKAGE_CH

gchar *	PACKAGE_SP

gchar *	PACKAGE_MS

gchar *	PACKAGE_TD

gchar *	PACKAGE_MOL

gchar *	PACKAGE_OGL

gchar *	PACKAGE_OGLM

gchar *	PACKAGE_OGLC

gchar *	PACKAGE_PRO

gchar *	PACKAGE_SET

gchar *	PACKAGE_LOGO

gchar *	PACKAGE_LAGPL

gchar *	PACKAGE_LABOUT

gchar *	PACKAGE_DOTA

gchar *	PACKAGE_DOTB

gchar *	PACKAGE_DOTC

gchar *	PACKAGE_DOTD

gchar *	PACKAGE_DOTE

gchar *	PACKAGE_DOTF

gchar *	PACKAGE_DOTG

gchar *	PACKAGE_DOTH

gchar *	PACKAGE_DFBD

gchar *	PACKAGE_DFAN

gchar *	PACKAGE_DFDI

gchar *	PACKAGE_DFTD

gchar *	PACKAGE_DFIN

gchar *	PACKAGE_SGCP

gchar *	PACKAGE_SGCI

gchar *	PACKAGE_SGCF

gchar *	PACKAGE_SGHP

gchar *	PACKAGE_SGTR

gchar *	PACKAGE_SGTI

gchar *	PACKAGE_SGTP

gchar *	PACKAGE_SGOP

gchar *	PACKAGE_SGOI

gchar *	PACKAGE_SGOC

gchar *	PACKAGE_SGOF

gchar *	PACKAGE_SGMP

gchar *	PACKAGE_SGMI

gchar *	PACKAGE_SGTC

gchar *	ATOMES_CONFIG

gchar *	ATOMES_URL

gchar *	mode_name [2]

gchar *	graph_img [NGRAPHS]

gchar *	dots [NDOTS]

gchar *	bravais_img [14]

gchar *	ifield [8]

gchar *	projfile

char *	ifbug

char *	coord_files [NCFORMATS+1]

char *	coord_files_ext [NCFORMATS+1]

char *	calc_name [NCALCS-2]

char *	graph_name [NGRAPHS]

char *	rings_type [5]

char *	untime [6]

gchar *	workspacefile

int	nprojects

int	activep

int	activev

int	activef

int	inactep

int	activew

int	statusval

int	atomes_visual

int	dialog_id

int	bonds_update

int	frag_update

int	mol_update

int	tmp_pixels [2]

int *	pasted_todo

atomic_object *	copied_object

GMainLoop *	Event_loop [5]

gboolean	in_movie_encoding

gboolean	newspace

gboolean	reading_input

gboolean	tmp_adv_bonding [2]

gboolean	column_label

gboolean	check_label

gboolean	object_motion

gboolean	selected_status

gboolean	silent_input

gboolean	cif_use_symmetry_positions

struct timespec	start_time

struct timespec	stop_time

double	opac

double	pi

GtkWidget *	MainWindow

GtkWidget *	MainView

GtkWidget *	MainFrame [2]

GtkWidget *	pop

GtkWidget *	curvetoolbox

GtkWidget *	progressbar

GtkWidget *	MainScrol [2]

GtkWidget *	atomes_logo

GtkWidget *	atomes_shortcuts

GtkWidget *	calc_dialog

GtkWidget *	register_button

GtkTextTag *	tag

GtkStatusbar *	statusbar

ColRGBA	std [6]

GdkPixbuf *	THETD

GdkPixbuf *	THEMO

GdkPixbuf *	THEBD

GdkPixbuf *	SETTING

GdkPixbuf *	SETTINGS

GdkPixbuf *	OGL

GdkPixbuf *	OGLM

GdkPixbuf *	OGLC

GdkPixbuf *	RUN

tint	cut_sel

tint	cut_lab

atomes_action	edition_acts []

atomes_action	analyze_acts []

GSimpleAction *	edition_actions [3]

GSimpleAction *	analyze_actions [9]

GtkApplication *	AtomesApp

workspace	workzone

project *	proj

chemical_data *	active_chem

coord_info *	active_coord

cell_info *	active_cell

box_info *	active_box

image *	active_image

glwin *	active_glwin

project *	active_project

project *	opengl_project

element_data	periodic_table_info []

double *	xsk

Detailed Description

Global variable declarations
Global convenience function declarations
Global data structure definitions.

Author: Sébastien Le Roux sebas.nosp@m.tien.nosp@m..lero.nosp@m.ux@i.nosp@m.pcms..nosp@m.unis.nosp@m.tra.f.nosp@m.r

Definition in file global.h.

Macro Definition Documentation

◆ ABOUT

#define ABOUT "help-about"

Definition at line 225 of file global.h.

◆ AFILE

#define AFILE "text-x-generic"

Definition at line 224 of file global.h.

◆ AN

#define AN 5

Definition at line 327 of file global.h.

◆ APPLY

#define APPLY "gtk-apply"

Definition at line 220 of file global.h.

◆ ATOM_LIMIT

#define ATOM_LIMIT 100000

atom number limit to compute fragment(s) and molecule(s) analysis automatically

◆ BD

#define BD 4

Definition at line 326 of file global.h.

◆ BSEP

#define BSEP 0

Definition at line 245 of file global.h.

◆ BV

#define BV 10

Definition at line 332 of file global.h.

◆ CANCEL

#define CANCEL "process-stop"

Definition at line 215 of file global.h.

◆ CH

#define CH 7

Definition at line 329 of file global.h.

◆ CHEM_M

#define CHEM_M 1

Definition at line 298 of file global.h.

◆ CHEM_N

#define CHEM_N 3

Definition at line 300 of file global.h.

◆ CHEM_PARAMS

#define CHEM_PARAMS 5

Definition at line 296 of file global.h.

◆ CHEM_R

#define CHEM_R 2

Definition at line 299 of file global.h.

◆ CHEM_X

#define CHEM_X 4

Definition at line 301 of file global.h.

◆ CHEM_Z

#define CHEM_Z 0

Definition at line 297 of file global.h.

◆ DEFAULT_ALPHA

#define DEFAULT_ALPHA 0.75

Definition at line 336 of file global.h.

◆ DEFAULT_FONT_SIZE

#define DEFAULT_FONT_SIZE 8

Definition at line 335 of file global.h.

◆ DELETEB

#define DELETEB "edit-delete"

Definition at line 222 of file global.h.

◆ DIAL_ERROR

#define DIAL_ERROR "dialog-error"

Definition at line 223 of file global.h.

◆ DPROPERTIES

#define DPROPERTIES "document-properties"

Definition at line 206 of file global.h.

◆ ECUT

#define ECUT "edit-cut"

Definition at line 205 of file global.h.

◆ EDITA

#define EDITA "edit-find-replace"

Definition at line 202 of file global.h.

◆ EDITC

#define EDITC "edit-copy"

Definition at line 203 of file global.h.

◆ EDITF

#define EDITF "edit-find"

Definition at line 204 of file global.h.

◆ ERROR_ATOM_A

#define ERROR_ATOM_A 5

Definition at line 284 of file global.h.

◆ ERROR_ATOM_B

#define ERROR_ATOM_B 6

Definition at line 285 of file global.h.

◆ ERROR_CHAINS

#define ERROR_CHAINS 11

Definition at line 290 of file global.h.

◆ ERROR_COORD

#define ERROR_COORD 9

Definition at line 288 of file global.h.

◆ ERROR_CURVE

#define ERROR_CURVE 3

Definition at line 282 of file global.h.

◆ ERROR_IMAGE

#define ERROR_IMAGE 4

Definition at line 283 of file global.h.

◆ ERROR_MOL

#define ERROR_MOL 12

◆ ERROR_NO_WAY

#define ERROR_NO_WAY 8

Definition at line 287 of file global.h.

◆ ERROR_PROJECT

#define ERROR_PROJECT 2

Definition at line 281 of file global.h.

◆ ERROR_RINGS

#define ERROR_RINGS 10

Definition at line 289 of file global.h.

◆ ERROR_RW

#define ERROR_RW 1

Definition at line 280 of file global.h.

◆ ERROR_UPDATE

#define ERROR_UPDATE 7

Definition at line 286 of file global.h.

◆ EXECUTE

#define EXECUTE "system-run"

Definition at line 216 of file global.h.

◆ FCLOSE

#define FCLOSE "window-close"

Definition at line 211 of file global.h.

◆ FEXIT

#define FEXIT "application-exit"

Definition at line 212 of file global.h.

◆ FF

#define FF 12

Definition at line 333 of file global.h.

◆ FITBEST

#define FITBEST "zoom-fit-best"

Definition at line 199 of file global.h.

◆ FNEW

#define FNEW "document-new"

Definition at line 207 of file global.h.

◆ FOPEN

#define FOPEN "document-open"

Definition at line 208 of file global.h.

◆ FSAVE

#define FSAVE "document-save"

Definition at line 209 of file global.h.

◆ FSAVEAS

#define FSAVEAS "document-save-as"

Definition at line 210 of file global.h.

◆ FULLSCREEN

#define FULLSCREEN "view-fullscreen"

Definition at line 198 of file global.h.

◆ GDK_SYNCHRONIZE

#define GDK_SYNCHRONIZE

Definition at line 39 of file global.h.

◆ GK

#define GK 3

Definition at line 325 of file global.h.

◆ GLOBAL_H_

#define GLOBAL_H_

Definition at line 43 of file global.h.

◆ GO_DOWN

#define GO_DOWN "go-down"

Definition at line 196 of file global.h.

◆ GO_LEFT

#define GO_LEFT "go-previous"

Definition at line 194 of file global.h.

◆ GO_RIGHT

#define GO_RIGHT "go-next"

Definition at line 193 of file global.h.

◆ GO_UP

#define GO_UP "go-up"

Definition at line 195 of file global.h.

◆ GR

#define GR 0

Definition at line 322 of file global.h.

◆ IODEBUG

#define IODEBUG FALSE

Definition at line 267 of file global.h.

◆ LINE_SIZE

#define LINE_SIZE 160

Definition at line 486 of file global.h.

◆ LIST_ADD

#define LIST_ADD "list-add"

Definition at line 213 of file global.h.

◆ LIST_REM

#define LIST_REM "list-remove"

Definition at line 214 of file global.h.

◆ max

#define max	(		a,
			b ) (a>=b?a:b)

Definition at line 80 of file global.h.

◆ MAXDATA

#define MAXDATA 21

Number of tabs for the description of the classical force field.

Definition at line 698 of file global.h.

◆ MAXDATC

#define MAXDATC 8

Number of tabs for the description of the classical calculation.

Definition at line 693 of file global.h.

◆ MEDIA_FAST

#define MEDIA_FAST "view-sort-descending"

Definition at line 192 of file global.h.

◆ MEDIA_FIRST

#define MEDIA_FIRST "go-first"

Definition at line 185 of file global.h.

◆ MEDIA_GOTO

#define MEDIA_GOTO "go-jump"

Definition at line 186 of file global.h.

◆ MEDIA_LAST

#define MEDIA_LAST "go-last"

Definition at line 184 of file global.h.

◆ MEDIA_LOOP

#define MEDIA_LOOP "view-refresh"

Definition at line 189 of file global.h.

◆ MEDIA_NEXT

#define MEDIA_NEXT "media-skip-forward"

Definition at line 182 of file global.h.

◆ MEDIA_PLAY

#define MEDIA_PLAY "media-playback-start"

Definition at line 187 of file global.h.

◆ MEDIA_PREV

#define MEDIA_PREV "media-skip-backward"

Definition at line 183 of file global.h.

◆ MEDIA_SLOW

#define MEDIA_SLOW "view-sort-ascending"

Definition at line 191 of file global.h.

◆ MEDIA_STOP

#define MEDIA_STOP "media-playback-stop"

Definition at line 188 of file global.h.

◆ MEDIA_ULOOP

#define MEDIA_ULOOP "edit-cut"

Definition at line 190 of file global.h.

◆ min

#define min	(		a,
			b ) (a<=b?a:b)

Definition at line 81 of file global.h.

◆ MINCUT

#define MINCUT 1.85

Definition at line 337 of file global.h.

◆ MS

#define MS 9

Definition at line 331 of file global.h.

◆ NCALCS

#define NCALCS 12

◆ NCFORMATS

#define NCFORMATS 12

Definition at line 318 of file global.h.

◆ NDOTS

#define NDOTS 8

◆ NGRAPHS

#define NGRAPHS 10

◆ NITEMS

#define NITEMS 16

Definition at line 320 of file global.h.

◆ OK

#define OK 0

Definition at line 279 of file global.h.

◆ OT

#define OT 4

Definition at line 321 of file global.h.

◆ PAGE_SETUP

#define PAGE_SETUP "document-page-setup"

Definition at line 197 of file global.h.

◆ RECORD

#define RECORD "media-record"

Definition at line 200 of file global.h.

◆ RI

#define RI 6

Definition at line 328 of file global.h.

◆ SK

#define SK 2

Definition at line 324 of file global.h.

◆ SP

#define SP 8

Definition at line 330 of file global.h.

◆ SQ

#define SQ 1

Definition at line 323 of file global.h.

◆ STEP_LIMIT

#define STEP_LIMIT 10000

Definition at line 277 of file global.h.

◆ YES

#define YES "gtk-yes"

Definition at line 201 of file global.h.

Typedef Documentation

◆ atom

atom

atom data structure

Definition at line 884 of file global.h.

◆ atomes_action

atomes_action

action information data structure

Definition at line 145 of file global.h.

◆ chemical_data

chemical_data

a structure to store some chemical information

Definition at line 849 of file global.h.

◆ classical_field

typedef struct classical_field classical_field

Definition at line 700 of file global.h.

◆ ColRGBA

typedef struct ColRGBA ColRGBA

Definition at line 119 of file global.h.

◆ coord_file

coord_file

atomic coordinates file, data container

Definition at line 501 of file global.h.

◆ coord_info

coord_info

coordination information data structure

Definition at line 156 of file global.h.

◆ cp2k

typedef struct cp2k cp2k

Definition at line 788 of file global.h.

◆ cpmd

typedef struct cpmd cpmd

Definition at line 769 of file global.h.

◆ Curve

Curve

curve data structure

Definition at line 606 of file global.h.

◆ CurveExtra

CurveExtra

extra curve(s) data information

Definition at line 581 of file global.h.

◆ CurveState

CurveState

data structure used for zoom in / out on curve widget

Definition at line 551 of file global.h.

◆ DataLayout

DataLayout

curve layout information

Definition at line 562 of file global.h.

◆ dint

typedef struct dint dint

Definition at line 95 of file global.h.

◆ dummy_atom

typedef struct dummy_atom dummy_atom

Definition at line 751 of file global.h.

◆ element_data

element_data

element description used for the periodic table defined in 'w_periodic.c'

Definition at line 836 of file global.h.

◆ ExtraSets

ExtraSets

list of extra data sets for a curve

Definition at line 594 of file global.h.

◆ insertion_menu

insertion_menu

data structure for the insertion pop-up menu

Definition at line 871 of file global.h.

◆ line_node

line_node

Definition at line 489 of file global.h.

◆ model

model

data structure to describe the topology

Definition at line 825 of file global.h.

◆ molecule

molecule

the molecule data structure

Definition at line 809 of file global.h.

◆ MouseState

MouseState

data structure to store mouse information on curve widget

Definition at line 538 of file global.h.

◆ project

project

data structure for the 'atomes' project

Definition at line 935 of file global.h.

◆ qint

typedef struct qint qint

Definition at line 110 of file global.h.

◆ shortcuts

shortcuts

keyboard shortcuts information

Definition at line 132 of file global.h.

◆ thermostat

typedef struct thermostat thermostat

Definition at line 733 of file global.h.

◆ tint

typedef struct tint tint

Definition at line 102 of file global.h.

◆ workspace

workspace

data structure for the 'atomes' workspace

Definition at line 1041 of file global.h.

Enumeration Type Documentation

◆ ContainerType

enum ContainerType

Enumerator
CONTAINER_WIN	0
CONTAINER_SCR	1
CONTAINER_VIE	2
CONTAINER_BUT	3
CONTAINER_FRA	4
CONTAINER_EXP	5

Definition at line 249 of file global.h.

◆ ImageFormats

enum ImageFormats

Enumerator
IMG_NONE	0
IMG_PIXBUF	1
IMG_SURFACE	2
IMG_FILE	3
IMG_STOCK	4

Definition at line 259 of file global.h.

Function Documentation

◆ abox()

GtkWidget * abox	(	GtkWidget *	box,
		char *	lab,
		int	vspace )

extern

box creating routine, to help design faster elements for the GUI

GtkWidget * bbox (GtkWidget * box, char * lab) GtkWidget * cbox (GtkWidget * box, char * lab) GtkWidget * fbox (GtkWidget * box, char * lab)

Definition at line 1912 of file gtk-misc.c.

◆ add_action()

void add_action ( GSimpleAction * action )

extern

add action to the main window action map

Parameters

action the GAction sending the signal the action to add

Definition at line 400 of file gui.c.

◆ add_advanced_item()

GtkWidget * add_advanced_item	(	GtkWidget *	menu,
		GCallback	handler,
		gpointer	data,
		gboolean	accel,
		guint	key,
		GdkModifierType	mod )

extern

◆ add_box_child_end()

void add_box_child_end	(	GtkWidget *	widg,
		GtkWidget *	child,
		gboolean	expand,
		gboolean	fill,
		int	padding )

extern

Add a GtkWidget in a GtkBox at the end position.

Parameters

widg	the GtkBox
child	the GtkWidget to add
expand	GTK3 only: expandable
fill	GTK3 only: fill
padding	GTK3 only: box padding

Definition at line 277 of file gtk-misc.c.

◆ add_box_child_start()

void add_box_child_start	(	int	orientation,
		GtkWidget *	widg,
		GtkWidget *	child,
		gboolean	expand,
		gboolean	fill,
		int	padding )

extern

Add a GtkWidget in a GtkBox at the initial position.

Parameters

orientation	horizontal or vertical
widg	the GtkBox
child	the GtkWidget to add
expand	GTK3 only: expandable
fill	GTK3 only: fill
padding	GTK3 only: box padding

Definition at line 299 of file gtk-misc.c.

◆ add_buffer()

GtkTextBuffer * add_buffer	(	GCallback	handler,
		gpointer	data,
		gchar *	text )

extern

create a GtkTextBuffer

Parameters

handler	the callback on buffer changed
data	the associated data pointer
text	the text to display

Definition at line 1171 of file gtk-misc.c.

◆ add_container_child()

void add_container_child	(	int	type,
		GtkWidget *	widg,
		GtkWidget *	child )

extern

Add a GtkWidget into another GtkWidget.

Parameters

type	GTK4 only: the type of container
widg	the container Gtkwidget
child	the child GtkWidget

Definition at line 226 of file gtk-misc.c.

◆ add_gtk_close_event()

void add_gtk_close_event	(	GtkWidget *	widg,
		GCallback	handler,
		gpointer	data )

extern

add a close event signal and callback to a GtkWidget

Parameters

widg	the GtkWidget
handler	the callback for the close event
data	the associated data pointer

Definition at line 2387 of file gtk-misc.c.

◆ add_menu_separator()

void add_menu_separator ( GtkWidget * menu )

extern

◆ add_vbox_to_layout()

GtkWidget * add_vbox_to_layout	(	GtkWidget *	layout,
		int	size_x,
		int	size_y )

extern

Insert a vertical GtkBox in a GtkLatout then send back the GtkBox.

Parameters

layout	the GtkLayout
size_x	the x size of the box
size_y	the y size of the box

Definition at line 864 of file gtk-misc.c.

◆ allocbool()

gboolean * allocbool ( int val )

extern

allocate a gboolean * pointer

Parameters

val	size of the pointer to allocate

Definition at line 254 of file global.c.

◆ allocdbool()

gboolean ** allocdbool	(	int	xal,
		int	yal )

extern

allocate a gboolean ** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate

Definition at line 270 of file global.c.

◆ allocddouble()

double ** allocddouble	(	int	xal,
		int	yal )

extern

allocate a double ** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate

Definition at line 475 of file global.c.

◆ allocdfloat()

float ** allocdfloat	(	int	xal,
		int	yal )

extern

allocate a float ** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate

Definition at line 414 of file global.c.

◆ allocdGLfloat()

GLfloat ** allocdGLfloat	(	int	xal,
		int	yal )

extern

allocate a GLfloat ** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate

Definition at line 161 of file glview.c.

◆ allocdgluint()

GLuint ** allocdgluint	(	int	xal,
		int	yal )

extern

allocate a GLuint ** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate

Definition at line 139 of file glview.c.

◆ allocdint()

int ** allocdint	(	int	xal,
		int	yal )

extern

allocate an int ** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate

Definition at line 330 of file global.c.

◆ allocdouble()

double * allocdouble ( int val )

extern

allocate a double * pointer

Parameters

val	size of the pointer to allocate

Definition at line 459 of file global.c.

◆ allocfloat()

float * allocfloat ( int val )

extern

allocate a float * pointer

Parameters

val	size of the pointer to allocate

Definition at line 398 of file global.c.

◆ allocgluint()

GLuint * allocgluint ( int val )

extern

allocate a GLuint * pointer

Parameters

val	size of the pointer to allocate

Definition at line 123 of file glview.c.

◆ allocint()

int * allocint ( int val )

extern

allocate an int * pointer

Parameters

val	size of the pointer to allocate

Definition at line 314 of file global.c.

◆ allocqdouble()

double **** allocqdouble	(	int	wal,
		int	xal,
		int	yal,
		int	zal )

extern

allocate a double **** pointer

Parameters

wal	1st dimension size of the pointer to allocate
xal	2nd dimension size of the pointer to allocate
yal	3rd dimension size of the pointer to allocate
zal	4th dimension size of the pointer to allocate

Definition at line 522 of file global.c.

◆ allocqint()

int **** allocqint	(	int	wal,
		int	xal,
		int	yal,
		int	zal )

extern

allocate an int **** pointer

Parameters

wal	1st dimension size of the pointer to allocate
xal	2nd dimension size of the pointer to allocate
yal	3rd dimension size of the pointer to allocate
zal	4th dimension size of the pointer to allocate

Definition at line 377 of file global.c.

◆ alloctbool()

gboolean *** alloctbool	(	int	xal,
		int	yal,
		int	zal )

extern

allocate a gboolean *** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate
zal	3rd dimension size of the pointer to allocate

Definition at line 293 of file global.c.

◆ alloctdouble()

double *** alloctdouble	(	int	xal,
		int	yal,
		int	zal )

extern

allocate a double *** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate
zal	3rd dimension size of the pointer to allocate

Definition at line 498 of file global.c.

◆ alloctfloat()

float *** alloctfloat	(	int	xal,
		int	yal,
		int	zal )

extern

allocate a float *** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate
zal	3rd dimension size of the pointer to allocate

Definition at line 437 of file global.c.

◆ alloctint()

int *** alloctint	(	int	xal,
		int	yal,
		int	zal )

extern

allocate an int *** pointer

Parameters

xal	1st dimension size of the pointer to allocate
yal	2nd dimension size of the pointer to allocate
zal	3rd dimension size of the pointer to allocate

Definition at line 353 of file global.c.

◆ append_menu_item()

void append_menu_item	(	GMenu *	menu,
		const gchar *	label,
		const gchar *	action,
		const gchar *	accel,
		const gchar *	custom,
		int	format,
		const gchar *	icon,
		gboolean	check,
		gboolean	status,
		gboolean	radio,
		const gchar *	rstatus )

extern

create a menu item, then append it to a menu

Parameters

menu	the menu to insert the item in
label	Label of the menu item
action	Action of the menu item
accel	Keyboard accelerator, if any
custom	Custom menu item ? NULL otherwise
format	Image format if not IMG_NONE
icon	Image data if not NULL
check	Check menu item ?
status	If check then status
radio	Radio menu item ?
rstatus	If radio then variant parameter

Definition at line 758 of file gui.c.

◆ append_submenu()

void append_submenu	(	GMenu *	menu,
		const gchar *	label,
		GMenu *	submenu )

extern

append a GMenuItem with a subenu to a GMenu, and use markup for the GMenuItem

Parameters

menu	the GMenu to insert the item with a submenu
label	the text for the menu item
submenu	the submenu to add to the menu item

Definition at line 728 of file gui.c.

◆ bbox()

GtkWidget * bbox	(	GtkWidget *	box,
		char *	lab )

extern

Definition at line 1921 of file gtk-misc.c.

◆ button_set_image()

void button_set_image	(	GtkButton *	but,
		gchar *	text,
		int	format,
		gpointer	image )

extern

Add an image to a GtkButton.

Parameters

but	the GtkButton
text	the message to display
format	the image format
image	the data of the image

Definition at line 1677 of file gtk-misc.c.

◆ calculation_time()

gchar * calculation_time	(	gboolean	modelv,
		double	ctime )

extern

get calculation time, human readable

Parameters

modelv	was an analysis performed ?
ctime	the calculation time

Definition at line 656 of file global.c.

◆ cbox()

GtkWidget * cbox	(	GtkWidget *	box,
		char *	lab )

extern

Definition at line 1931 of file gtk-misc.c.

◆ check_button()

GtkWidget * check_button	(	gchar *	text,
		int	dimx,
		int	dimy,
		gboolean	state,
		GCallback	handler,
		gpointer	data )

extern

create a check button

Parameters

text	the message to display
dimx	the x size
dimy	the y size
state	Checked or not (1/0)
handler	the callback for the button
data	the associated data pointer

Definition at line 1799 of file gtk-misc.c.

◆ clean_chains_data()

void clean_chains_data ( glwin * view )

extern

cleaning the OpenGL data related to chain statistics

Parameters

view	the gliwn to clean the data from

Definition at line 258 of file chainscall.c.

◆ clean_rings_data()

void clean_rings_data	(	int	rid,
		glwin *	view )

extern

clean a ring type data for a glview

Parameters

rid	Rings type
view	the glview

Definition at line 374 of file ringscall.c.

◆ clean_volumes_data()

void clean_volumes_data ( glwin * view )

extern

clean volume data

Parameters

view	the target glwin

Definition at line 83 of file w_volumes.c.

◆ color_button()

GtkWidget * color_button	(	ColRGBA	col,
		gboolean	alpha,
		int	dimx,
		int	dimy,
		GCallback	handler,
		gpointer	data )

extern

create a color selection button

Parameters

col	the color to use
alpha	Use alpha channel (1/0)
dimx	Size x of the button
dimy	Size y of the button
handler	the callback for the button
data	the associated data pointer

Definition at line 1728 of file gtk-misc.c.

◆ colrgba_togtkrgba()

GdkRGBA colrgba_togtkrgba ( ColRGBA col )

extern

convert ColRGBA color to GdkRGBA color

Parameters

col	the ColRGBA to convert

Definition at line 1634 of file gtk-misc.c.

◆ combo_text_append()

void combo_text_append	(	GtkWidget *	combo,
		gchar *	text )

extern

append text in GtkComboBox widget

Parameters

combo	the GtkWidget
text	the text to append

Definition at line 900 of file gtk-misc.c.

◆ combo_text_prepend()

void combo_text_prepend	(	GtkWidget *	combo,
		gchar *	text )

extern

prepend text in GtkComboBox widget

Parameters

combo	the GtkWidget
text	the text to prepend

Definition at line 913 of file gtk-misc.c.

◆ convert_to_pixbuf()

GdkPixbuf * convert_to_pixbuf ( cairo_surface_t * surf )

extern

convert cairo surface to GdkPixbuf

Parameters

surf	the cairo sufrace to convert

Definition at line 1264 of file gtk-misc.c.

◆ create_button()

GtkWidget * create_button	(	gchar *	text,
		int	image_format,
		gchar *	image,
		int	dimx,
		int	dimy,
		int	relief,
		GCallback	handler,
		gpointer	data )

extern

create a simple button

Parameters

text	the message to display
image_format	the image format
image	the name of the stock image
dimx	the x size
dimy	the y size
relief	button should appear pressed or not (1/0)
handler	the callback for the button
data	the associated data pointer

Definition at line 1863 of file gtk-misc.c.

◆ create_combo()

GtkWidget * create_combo ( )

extern

create a GtkCombox widget, note deprecated in GTK4

Definition at line 923 of file gtk-misc.c.

◆ create_entry()

GtkWidget * create_entry	(	GCallback	handler,
		int	dim,
		int	cdim,
		gboolean	key_release,
		gpointer	data )

extern

Create a GtkEntry.

Parameters

handler	the callback
dim	the x size
cdim	the maximum number of character to display
key_release	Use release event (1/0)
data	the data pointer for the callback

Definition at line 1314 of file gtk-misc.c.

◆ create_expander()

GtkWidget * create_expander	(	gchar *	name,
		gchar *	file_img )

extern

create GtkExpander

Parameters

name	Name of the expander tab
file_img	image file to add if required

Definition at line 1984 of file gtk-misc.c.

◆ create_file_chooser()

GtkWidget * create_file_chooser	(	const gchar *	title,
		GtkWindow *	parent,
		GtkFileChooserAction	act,
		const gchar *	act_name )

extern

create a GtkFileChooser, utility to select file(s)

Parameters

title	the title of the window
parent	the parent window, if any
act	the action to perform (read or write)
act_name	the action name to display

Definition at line 2223 of file gtk-misc.c.

◆ create_hbox()

GtkWidget * create_hbox ( int spacing )

extern

create a GtkBox with horizontal orientation

Parameters

spacing spacing between elements

Definition at line 813 of file gtk-misc.c.

◆ create_hscale()

GtkWidget * create_hscale	(	float	min,
		float	max,
		float	delta,
		float	val,
		int	pos,
		int	round,
		int	size,
		GCallback	handler,
		GCallback	scroll_handler,
		gpointer	data )

extern

create an horizontal scale GtkWidget

Parameters

min	Min value for the h scale
max	Max value for the h scale
delta	the step on the h scale
val	the value to position to set on the h scale
pos	the location where the value is on display
round	the rounding digit for the value on display
size	the x size of the GtkWdiget
handler	the callback to move the h scale
scroll_handler	the callback on mouse scroll
data	the associated data pointer

Definition at line 744 of file gtk-misc.c.

◆ create_image_from_data()

GtkWidget * create_image_from_data	(	int	format,
		gpointer	item_image )

extern

create Gtk image for data

Parameters

format	Image format
item_image	the data to create the image

Definition at line 1443 of file gtk-misc.c.

◆ create_layout()

GtkWidget * create_layout	(	int	x,
		int	y )

extern

create a GtkLayout / GtkFixed widget

Parameters

x	the x size of the widget
y	the y size of the widget

Definition at line 880 of file gtk-misc.c.

◆ create_menu_item()

GtkWidget * create_menu_item	(	gboolean	add_mnemo,
		gchar *	action )

extern

◆ create_menu_item_from_widget()

GtkWidget * create_menu_item_from_widget	(	GtkWidget *	widg,
		gboolean	check,
		gboolean	radio,
		gboolean	status )

extern

◆ create_scroll()

GtkWidget * create_scroll	(	GtkWidget *	box,
		int	dimx,
		int	dimy,
		int	shadow )

extern

create a scroll window

Parameters

box	the box to insert the scroll window in, if any
dimx	the x size of the widget
dimy	the x size of the widget
shadow	Add shadow (1/0)

Definition at line 1960 of file gtk-misc.c.

◆ create_text_view()

GtkWidget * create_text_view	(	int	dimx,
		int	dimy,
		int	edit,
		int	mono,
		GCallback	handler,
		gpointer	data,
		gchar *	text )

extern

create a GtkTextView and display some text

Parameters

dimx	the x size of the GtkTextView
dimy	the y size of the GtkTextView
edit	Is the text view editable (1/0)
mono	Use monospace font (1/0)
handler	the callback on buffer changed
data	the associated data pointer
text	the text to display

Definition at line 1199 of file gtk-misc.c.

◆ create_vbox()

GtkWidget * create_vbox ( int spacing )

extern

create a GtkBox with vertical orientation

Parameters

spacing spacing between elements

Definition at line 801 of file gtk-misc.c.

◆ create_vscale()

GtkWidget * create_vscale	(	float	min,
		float	max,
		float	delta,
		float	val,
		int	pos,
		int	round,
		int	size,
		GCallback	handler,
		GCallback	scroll_handler,
		gpointer	data )

extern

create an vertical scale GtkWidget

Parameters

min	Min value for the v scale
max	Max value for the v scale
delta	the step on the v scale
val	the value to position to set on the h scale
pos	the location where the value is on display
round	the rounding digit for the value on display
size	the x size of the GtkWdiget
handler	the callback to move the v scale
scroll_handler	the callback on mouse scroll
data	the associated data pointer

Definition at line 778 of file gtk-misc.c.

◆ create_win()

GtkWidget * create_win	(	gchar *	str,
		GtkWidget *	parent,
		gboolean	modal,
		gboolean	resiz )

extern

create a new GtkWindow

Parameters

str	Title
parent	Parent GtkWidget (if any)
modal	Modal (TRUE/FALSE)
resiz	Can be re-sized (TRUE/FALSE)

Definition at line 445 of file gtk-misc.c.

◆ cutoffsend()

void cutoffsend ( )

extern

send cutoffs to Fortran90

Definition at line 243 of file bdcall.c.

◆ destroy_this_dialog()

void destroy_this_dialog ( GtkDialog * dialog )

extern

destroy a GtkDialog

Parameters

dialog the GtkDialog to destroy

Definition at line 2065 of file gtk-misc.c.

◆ destroy_this_native_dialog()

void destroy_this_native_dialog ( GtkNativeDialog * dialog )

extern

destroy a GtkNativeDialog

Parameters

dialog the GtkNativeDialog to destroy

Definition at line 2084 of file gtk-misc.c.

◆ destroy_this_widget()

GtkWidget * destroy_this_widget ( GtkWidget * widg )

extern

destroy a GtkWidget

Parameters

widg	the GtkWidget to destroy

Definition at line 2034 of file gtk-misc.c.

◆ destroy_this_window()

G_MODULE_EXPORT gboolean destroy_this_window	(	GtkWidget *	win,
		GdkEvent *	event,
		gpointer	data )

extern

destroy a GtkWindow

Parameters

win	the GtkWindow to destroy
event	the GdkEvent triggering the signal
data	the associated data pointer

Definition at line 2344 of file gtk-misc.c.

◆ dialog_cancel_apply()

GtkWidget * dialog_cancel_apply	(	gchar *	title,
		GtkWidget *	parent,
		gboolean	resiz )

extern

create a dialog modal offering a choice to apply something or not

Parameters

title	the message
parent	the parent window, if any
resiz	Is the new window re-sizable ?

Definition at line 561 of file gtk-misc.c.

◆ dialog_get_content_area()

GtkWidget * dialog_get_content_area ( GtkWidget * widg )

extern

prepare GtkWidget to insert content in a GtkDialog window

Parameters

widg	the GtkDialog window

Definition at line 825 of file gtk-misc.c.

◆ dialogmodal()

GtkWidget * dialogmodal	(	gchar *	str,
		GtkWindow *	parent )

extern

Create a new dialog modal window.

Parameters

str	Title
parent	Parent GtkWindow, if any

Definition at line 510 of file gtk-misc.c.

◆ duplicate_bool()

gboolean * duplicate_bool	(	int	num,
		gboolean *	old_val )

extern

copy a list of gboolean

Parameters

num	number of elements in the list
old_val	the list to copy

Definition at line 576 of file global.c.

◆ duplicate_color()

ColRGBA * duplicate_color	(	int	num,
		ColRGBA *	col )

extern

duplicate a ColRGBA pointer

Parameters

num	Size of the pointer
col	ColRGBA pointer to duplicate

Definition at line 1602 of file gtk-misc.c.

◆ duplicate_double()

double * duplicate_double	(	int	num,
		double *	old_val )

extern

copy a list of double

Parameters

num	number of elements in the list
old_val	the list to copy

Definition at line 608 of file global.c.

◆ duplicate_float()

float * duplicate_float	(	int	num,
		float *	old_val )

extern

copy a list of float

Parameters

num	number of elements in the list
old_val	the list to copy

Definition at line 592 of file global.c.

◆ duplicate_int()

int * duplicate_int	(	int	num,
		int *	old_val )

extern

copy a list of int

Parameters

num	number of elements in the list
old_val	the list to copy

Definition at line 560 of file global.c.

◆ duplicate_strings()

gchar ** duplicate_strings	(	int	num,
		gchar **	old_val )

extern

copy a list of strings

Parameters

num	number of elements in the list
old_val	the list to copy

Definition at line 544 of file global.c.

◆ edit_in_new_project()

G_MODULE_EXPORT void edit_in_new_project	(	GtkWidget *	widg,
		gpointer	data )

extern

create new project using selection callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 2192 of file popup.c.

◆ entry_get_text()

const gchar * entry_get_text ( GtkEntry * entry )

extern

get the text in a GtkEntry

Parameters

entry the GtkEntry

Definition at line 597 of file gtk-misc.c.

◆ fbox()

GtkWidget * fbox	(	GtkWidget *	box,
		char *	lab )

extern

Definition at line 1941 of file gtk-misc.c.

◆ file_chooser_get_current_folder()

gchar * file_chooser_get_current_folder ( GtkFileChooser * chooser )

extern

get the current folder for a GtkFileChooser

Parameters

chooser the GtkFilechooser

Definition at line 2152 of file gtk-misc.c.

◆ file_chooser_get_file_name()

gchar * file_chooser_get_file_name ( GtkFileChooser * chooser )

extern

get a file name from a GtkFileChooser (single file selected)

Parameters

chooser the GtkFilechooser

Definition at line 2136 of file gtk-misc.c.

◆ file_chooser_get_file_names()

GList * file_chooser_get_file_names ( GtkFileChooser * chooser )

create a file list from files selected using a GtkFileChooser

Definition at line 2123 of file gtk-misc.c.

◆ file_chooser_set_current_folder()

void file_chooser_set_current_folder ( GtkFileChooser * chooser )

extern

set current folder in a GtkFilechooser

Parameters

chooser the GtkFilechooser

Definition at line 2188 of file gtk-misc.c.

◆ file_chooser_set_file_name()

gboolean file_chooser_set_file_name	(	GtkFileChooser *	chooser,
		gchar *	filename )

extern

set file name in a GtkFilechooser

Parameters

chooser	the GtkFilechooser
filename	the file name to appear in the GtkFilechooser

Definition at line 2169 of file gtk-misc.c.

◆ font_button()

GtkWidget * font_button	(	gchar *	font,
		int	dimx,
		int	dimy,
		GCallback	handler,
		gpointer	data )

extern

create a font selection button

Parameters

font	the font to use
dimx	Size x of the button
dimy	Size y of the button
handler	the callback for the button
data	the associated data pointer

Definition at line 1750 of file gtk-misc.c.

◆ gdkrgba_to_rgba()

ColRGBA gdkrgba_to_rgba ( GdkRGBA colgdk )

extern

convert GdkRGBA color to ColRGBA color

Parameters

colgdk the GdkRGBA to convert

Definition at line 1617 of file gtk-misc.c.

◆ get_button_color()

ColRGBA get_button_color ( GtkColorChooser * colob )

extern

get the ColRGBA color from a GtkColorChooser button

Parameters

colob the GtkColorChooser button

Definition at line 2236 of file gtk-misc.c.

◆ get_calc_time()

double get_calc_time	(	struct timespec	start,
		struct timespec	stop )

extern

get calculation time in s

Parameters

start	the initial time
stop	the final time

Definition at line 643 of file global.c.

◆ get_project_by_id()

project * get_project_by_id ( int p )

extern

get project pointer using id number

Parameters

p	the id number

Definition at line 120 of file project.c.

◆ get_top_level()

GtkWidget * get_top_level ( GtkWidget * widg )

extern

get the top level container, window, of a widget

Parameters

widg	the GtkWidget

Definition at line 2315 of file gtk-misc.c.

◆ get_widget_height()

int get_widget_height ( GtkWidget * widg )

extern

retrive GtkWidget height

Parameters

widg	the GtkWidget

Definition at line 2419 of file gtk-misc.c.

◆ get_widget_width()

int get_widget_width ( GtkWidget * widg )

extern

retrive GtkWidget width

Parameters

widg	the GtkWidget

Definition at line 2403 of file gtk-misc.c.

◆ get_window_color()

ColRGBA get_window_color ( GtkWidget * color_win )

extern

get the ColRGBA color from a color selection window

Parameters

color_win the color selection window

Definition at line 2250 of file gtk-misc.c.

◆ gtk3_menu_item()

GtkWidget * gtk3_menu_item	(	GtkWidget *	menu,
		gchar *	name,
		int	icon_format,
		gpointer	item_icon,
		GCallback	handler,
		gpointer	data,
		gboolean	accel,
		guint	key,
		GdkModifierType	mod,
		gboolean	check,
		gboolean	radio,
		gboolean	status )

extern

◆ gtk_label_align()

void gtk_label_align	(	GtkWidget *	lab,
		float	ax,
		float	ay )

extern

set text alignment in a GtkLabel

Parameters

lab	the GtkLabel
ax	the x alignment
ay	the Y alignment

Definition at line 701 of file gtk-misc.c.

◆ hide_the_widgets()

void hide_the_widgets ( GtkWidget * widg )

extern

hide GtkWidget

Parameters

widg	the GtkWidget to show

Definition at line 189 of file gtk-misc.c.

◆ hide_this_window()

G_MODULE_EXPORT gboolean hide_this_window	(	GtkWidget *	win,
		GdkEvent *	event,
		gpointer	data )

extern

hide a GtkWindow

Parameters

win	the GtkWindow to hide
event	the GdkEvent triggering the signal
data	the associated data pointer

Definition at line 2371 of file gtk-misc.c.

◆ in_md_shaders()

gboolean in_md_shaders	(	project *	this_proj,
		int	id )

extern

is this shader MD dependent ?

Parameters

this_proj	the target project
id	the shader id

Definition at line 632 of file ogl_shading.c.

◆ initcutoffs()

void initcutoffs	(	chemical_data *	chem,
		int	species )

extern

initialize bond cutoffs

Parameters

chem	the target chemical data
species	the number of chemical species

Definition at line 207 of file bdcall.c.

◆ is_atom_win_active()

gboolean is_atom_win_active ( glwin * view )

extern

is the model edition window visible ?

Parameters

view	the target glwin

Definition at line 71 of file atom_edit.c.

◆ is_the_widget_visible()

gboolean is_the_widget_visible ( GtkWidget * widg )

extern

test if a GtkWidget exist, then return if it is visible or not

Parameters

widg	the GtkWidget

Definition at line 714 of file gtk-misc.c.

◆ label_unlabel_atoms()

G_MODULE_EXPORT void label_unlabel_atoms	(	GtkWidget *	widg,
		gpointer	data )

extern

label / unlabel a type of atom(s) callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1503 of file popup.c.

◆ label_unlabel_coord()

G_MODULE_EXPORT void label_unlabel_coord	(	GtkWidget *	widg,
		gpointer	data )

extern

label / unlabel a type of coordination callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1839 of file popup.c.

◆ label_unlabel_this_atom()

G_MODULE_EXPORT void label_unlabel_this_atom	(	GtkWidget *	widg,
		gpointer	data )

extern

label / unlabel this atom callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1128 of file popup.c.

◆ layout_add_widget()

void layout_add_widget	(	GtkWidget *	layout,
		GtkWidget *	child,
		int	x_pos,
		int	y_pos )

extern

Add a GtkWidget in a GtkLayout.

Parameters

layout	the GtkLayout
child	the GtkWidget to insert
x_pos	the x position to insert at
y_pos	the y position to insert at

Definition at line 846 of file gtk-misc.c.

◆ markup_label()

GtkWidget * markup_label	(	gchar *	text,
		int	dimx,
		int	dimy,
		float	ax,
		float	ay )

extern

Definition at line 1585 of file gtk-misc.c.

◆ menu_item_new_with_submenu()

GtkWidget * menu_item_new_with_submenu	(	gchar *	name,
		gboolean	active,
		GtkWidget *	sub_menu )

extern

◆ message_dialogmodal()

GtkWidget * message_dialogmodal	(	gchar *	message,
		gchar *	title,
		GtkMessageType	mtype,
		GtkButtonsType	buttons,
		GtkWidget *	parent )

extern

create a modal (cannot be ignored) message window

Parameters

message	the message
title	the title
mtype	the message type
buttons	the type of closing button to add
parent	the parent window, if any

Definition at line 531 of file gtk-misc.c.

◆ new_gtk_window()

GtkWidget * new_gtk_window ( )

extern

create a new GtkWindow

Definition at line 348 of file gtk-misc.c.

◆ on_calc_bonds_released()

G_MODULE_EXPORT void on_calc_bonds_released	(	GtkWidget *	widg,
		gpointer	data )

extern

compute bonding properties

Parameters

widg	the GtkWidget sending the signal, if any
data	the associated data pointer

Definition at line 471 of file bdcall.c.

◆ opengl_project_changed()

void opengl_project_changed ( int id )

extern

change the OpenGL project

Parameters

id	the id of the new OpenGL project

Definition at line 245 of file update_p.c.

◆ pop_menu_at_pointer()

void pop_menu_at_pointer	(	GtkWidget *	widg,
		GdkEvent *	event )

extern

popup a menu at pointer location

Parameters

widg	the menu to popup
event	the GdkEvent triggering the signal

Definition at line 2301 of file gtk-misc.c.

◆ prepare_for_title()

gchar * prepare_for_title ( gchar * init )

extern

prepare a string for a window title, getting rid of all markup

Parameters

init	the initial string

Definition at line 71 of file tools.c.

◆ provide_gtk_css()

void provide_gtk_css ( gchar * css )

extern

create a css provider based on the css data

Parameters

css	the css data, use the name of the variable to use the css

Definition at line 2006 of file gtk-misc.c.

◆ radio_button()

GtkWidget * radio_button	(	gchar *	text,
		int	dimx,
		int	dimy,
		gboolean	state,
		GCallback	handler,
		gpointer	data )

extern

create a radio button

Parameters

text	the message to display
dimx	the x size
dimy	the y size
state	Checked or not (1/0)
handler	the callback for the button
data	the associated data pointer

Definition at line 1834 of file gtk-misc.c.

◆ recreate_all_shaders()

void recreate_all_shaders ( glwin * view )

extern

re-initialize all OpenGL shaders

Parameters

view	the target glwin

Definition at line 713 of file ogl_shading.c.

◆ remove_action()

void remove_action ( gchar * action_name )

extern

add action from the main window action map

Parameters

action_name the action to remove

Definition at line 412 of file gui.c.

◆ remove_edition_actions()

void remove_edition_actions ( )

extern

remove all edition actions

Definition at line 422 of file gui.c.

◆ remove_edition_and_analyze_actions()

void remove_edition_and_analyze_actions ( )

extern

remove all edition and analysis action

Definition at line 433 of file gui.c.

◆ remove_the_atoms()

G_MODULE_EXPORT void remove_the_atoms	(	GtkWidget *	widg,
		gpointer	data )

extern

remove selected atom(s) callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1297 of file popup.c.

◆ replace_the_atoms()

G_MODULE_EXPORT void replace_the_atoms	(	GtkWidget *	widg,
		gpointer	data )

extern

replace selected atom(s) callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1326 of file popup.c.

◆ resize_this_window()

void resize_this_window	(	GtkWidget *	window,
		int	x,
		int	y )

extern

resize this GtkWindow

Parameters

window	the GtkWidget to resize
x	the x size
y	the y size

Definition at line 581 of file gtk-misc.c.

◆ run_destroy_dialog()

G_MODULE_EXPORT void run_destroy_dialog	(	GtkDialog *	dialog,
		gint	response_id,
		gpointer	data )

extern

to destroy a GtkDialog when the dialog emit the closing signal

Parameters

dialog	the GtkDialog to destroy
response_id	the response id
data	the associated data pointer

Definition at line 2102 of file gtk-misc.c.

◆ run_this_gtk_dialog()

void run_this_gtk_dialog	(	GtkWidget *	dial,
		GCallback	handler,
		gpointer	data )

extern

run a GTK (3 and 4) basic GtkDialog

Parameters

dial	the GtkDialog
handler	the callback
data	the associated data pointer

Definition at line 492 of file gtk-misc.c.

◆ select_unselect_atoms()

G_MODULE_EXPORT void select_unselect_atoms	(	GtkWidget *	widg,
		gpointer	data )

extern

select / unselect a type of atom(s) callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1551 of file popup.c.

◆ select_unselect_coord()

G_MODULE_EXPORT void select_unselect_coord	(	GtkWidget *	widg,
		gpointer	data )

extern

select / unselect a type of coordination callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1915 of file popup.c.

◆ select_unselect_this_atom()

G_MODULE_EXPORT void select_unselect_this_atom	(	GtkWidget *	widg,
		gpointer	data )

extern

select / unselect this atom callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1177 of file popup.c.

◆ set_color_chooser_color()

void set_color_chooser_color	(	GtkWidget *	color_win,
		ColRGBA	col )

extern

set the color of a color selection window

Parameters

color_win	the color selection window
col	the color to use

Definition at line 2265 of file gtk-misc.c.

◆ set_image_from_icon_name()

void set_image_from_icon_name	(	GtkWidget *	widg,
		gchar *	icon )

extern

set a image from a stock icon name

Parameters

widg	the GtkImage to modify
icon	the name of the stock icon

Definition at line 1894 of file gtk-misc.c.

◆ set_renderer_color()

void set_renderer_color	(	int	tocol,
		GtkCellRenderer *	renderer,
		ColRGBA	col )

extern

set the color of a GtkCellRenderer

Parameters

tocol	Apply color (1/0)
renderer	the GtkCellRenderer
col	the color to apply

Definition at line 1653 of file gtk-misc.c.

◆ show_hide_atoms()

G_MODULE_EXPORT void show_hide_atoms	(	GtkWidget *	widg,
		gpointer	data )

extern

◆ show_hide_coord()

G_MODULE_EXPORT void show_hide_coord	(	GtkWidget *	widg,
		gpointer	data )

extern

show/hide coordination callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 106 of file m_coord.c.

◆ show_hide_labels()

G_MODULE_EXPORT void show_hide_labels	(	GtkWidget *	widg,
		gpointer	data )

extern

◆ show_hide_poly()

G_MODULE_EXPORT void show_hide_poly	(	GtkWidget *	widg,
		gpointer	data )

extern

show / hide polyhedra callback - GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 79 of file m_poly.c.

◆ show_hide_the_coord()

G_MODULE_EXPORT void show_hide_the_coord	(	GtkWidget *	widg,
		gpointer	data )

extern

show / hide a type of coordination callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1788 of file popup.c.

◆ show_hide_this_atom()

G_MODULE_EXPORT void show_hide_this_atom	(	GtkWidget *	widg,
		gpointer	data )

extern

show / hide this atom callback GTK3

Parameters

widg	the GtkWidget sending the signal
data	the associated data pointer

Definition at line 1019 of file popup.c.

◆ show_the_widgets()

void show_the_widgets ( GtkWidget * widg )

extern

show GtkWidget

Parameters

widg	the GtkWidget to show

Definition at line 173 of file gtk-misc.c.

◆ spin_button()

GtkWidget * spin_button	(	GCallback	handler,
		double	value,
		double	start,
		double	end,
		double	step,
		int	digits,
		int	dim,
		gpointer	data )

extern

create a spin button

Parameters

handler	the callback for the button
value	Initial value for the spin button
start	Minimum value
end	Maximum value
step	Step between values
digits	Number of digits displayed
dim	Size x of the button
data	the associated data pointer

Definition at line 1772 of file gtk-misc.c.

◆ stock_image()

GtkWidget * stock_image ( const gchar * stock_id )

extern

create a GtkImage for the Gtk database

Parameters

stock_id

Definition at line 1364 of file gtk-misc.c.

◆ string_to_double()

double string_to_double ( gpointer string )

extern

convert string to double

Parameters

string the string to convert

Definition at line 624 of file global.c.

◆ text_view_set_monospace()

void text_view_set_monospace ( GtkWidget * view )

extern

set the font of a GtkTextView as monospace

Parameters

view	the GtkTextView

Definition at line 687 of file gtk-misc.c.

◆ update_chains_menus()

void update_chains_menus ( glwin * view )

extern

◆ update_entry_double()

void update_entry_double	(	GtkEntry *	entry,
		double	doubleval )

extern

update the content of a GtkEntry as double

Parameters

entry	the GtkEntry
doubleval	the new double value to display

Definition at line 633 of file gtk-misc.c.

◆ update_entry_int()

void update_entry_int	(	GtkEntry *	entry,
		int	intval )

extern

update the content of a GtkEntry as int

Parameters

entry	the GtkEntry
intval	the new int value to display

Definition at line 614 of file gtk-misc.c.

◆ update_entry_long_double()

void update_entry_long_double	(	GtkEntry *	entry,
		double	doubleval )

extern

update the content of a GtkEntry as long double

Parameters

entry	the GtkEntry
doubleval	the new long double value to display

Definition at line 652 of file gtk-misc.c.

◆ update_entry_text()

void update_entry_text	(	GtkEntry *	entry,
		gchar *	text )

extern

update the content of a GtkEntry as string

Parameters

entry	the GtkEntry
text	the new string to display

Definition at line 671 of file gtk-misc.c.

◆ update_rings_menus()

void update_rings_menus ( glwin * view )

extern

◆ widget_add_action()

void widget_add_action	(	GSimpleActionGroup *	action_group,
		const gchar *	act,
		GCallback	handler,
		gpointer	data,
		gboolean	check,
		gboolean	status,
		gboolean	radio,
		const gchar *	stat )

extern

add an action to an action group

Parameters

action_group	the action group to add an action to
act	the name of the action to add
handler	the associated callback
data	the associated data pointer
check	is the action a check (1/0)
status	if check or radio, status of the action (1/0)
radio	is the action a radio (1/0)
stat	if radio variant parameter of the action

Definition at line 641 of file gui.c.

◆ widget_set_sensitive()

void widget_set_sensitive	(	GtkWidget *	widg,
		gboolean	sensitive )

extern

Set sensitivity for a GtkWidget, ensuring it is a GtkWidget.

Parameters

widg	the GtkWidget
sensitive	Sensitivity

Definition at line 206 of file gtk-misc.c.

Variable Documentation

◆ active_box

box_info* active_box

extern

Definition at line 51 of file project.c.

◆ active_cell

cell_info* active_cell

extern

Definition at line 50 of file project.c.

◆ active_chem

chemical_data* active_chem

extern

Definition at line 48 of file project.c.

◆ active_coord

coord_info* active_coord

extern

Definition at line 49 of file project.c.

◆ active_glwin

glwin* active_glwin

extern

Definition at line 53 of file project.c.

◆ active_image

image* active_image

extern

Definition at line 52 of file project.c.

◆ active_project

project* active_project

extern

Definition at line 47 of file project.c.

◆ activef

int activef

extern

Definition at line 161 of file global.c.

◆ activep

int activep

extern

Definition at line 159 of file global.c.

◆ activev

int activev

extern

Definition at line 160 of file global.c.

◆ activew

int activew

extern

Definition at line 163 of file global.c.

◆ analyze_actions

GSimpleAction* analyze_actions[9]

extern

Definition at line 198 of file global.c.

◆ analyze_acts

atomes_action analyze_acts[]

extern

Definition at line 112 of file gui.c.

◆ ATOMES_CONFIG

gchar* ATOMES_CONFIG

extern

Definition at line 135 of file global.c.

◆ atomes_logo

GtkWidget* atomes_logo

extern

Definition at line 208 of file global.c.

◆ atomes_shortcuts

GtkWidget* atomes_shortcuts

extern

Definition at line 209 of file global.c.

◆ ATOMES_URL

gchar* ATOMES_URL

extern

Definition at line 136 of file global.c.

◆ atomes_visual

int atomes_visual

extern

Definition at line 165 of file global.c.

◆ AtomesApp

GtkApplication* AtomesApp

extern

Definition at line 200 of file global.c.

◆ bonds_update

int bonds_update

extern

Definition at line 169 of file global.c.

◆ bravais_img

gchar* bravais_img[14]

extern

Definition at line 138 of file global.c.

◆ calc_dialog

GtkWidget* calc_dialog

extern

Definition at line 210 of file global.c.

◆ calc_name

char* calc_name[NCALCS-2]

extern

Definition at line 122 of file gui.c.

◆ check_label

gboolean check_label

extern

Definition at line 185 of file global.c.

◆ cif_use_symmetry_positions

gboolean cif_use_symmetry_positions

extern

Definition at line 189 of file global.c.

◆ column_label

gboolean column_label

extern

Definition at line 184 of file global.c.

◆ coord_files

char* coord_files[NCFORMATS+1]

extern

Definition at line 86 of file callbacks.c.

◆ coord_files_ext

char* coord_files_ext[NCFORMATS+1]

extern

Definition at line 100 of file callbacks.c.

◆ copied_object

atomic_object* copied_object

extern

Definition at line 123 of file glwindow.c.

◆ curvetoolbox

GtkWidget* curvetoolbox

extern

Definition at line 205 of file global.c.

◆ cut_lab

tint cut_lab

extern

Definition at line 145 of file gui.c.

◆ cut_sel

tint cut_sel

extern

Definition at line 144 of file gui.c.

◆ dialog_id

int dialog_id

extern

Definition at line 167 of file global.c.

◆ dots

gchar* dots[NDOTS]

extern

Definition at line 104 of file gui.c.

◆ edition_actions

GSimpleAction* edition_actions[3]

extern

Definition at line 197 of file global.c.

◆ edition_acts

atomes_action edition_acts[]

extern

Definition at line 108 of file gui.c.

◆ Event_loop

GMainLoop* Event_loop[5]

extern

Definition at line 178 of file global.c.

◆ frag_update

int frag_update

extern

Definition at line 170 of file global.c.

◆ graph_img

gchar* graph_img[NGRAPHS]

extern

Definition at line 106 of file gui.c.

◆ graph_name

char* graph_name[NGRAPHS]

extern

Definition at line 133 of file gui.c.

◆ ifbug

char* ifbug

extern

Definition at line 141 of file global.c.

◆ ifield

gchar* ifield[8]

extern

Definition at line 139 of file global.c.

◆ in_movie_encoding

gboolean in_movie_encoding

extern

Definition at line 180 of file global.c.

◆ inactep

int inactep

extern

Definition at line 162 of file global.c.

◆ MainFrame

GtkWidget* MainFrame[2]

extern

Definition at line 203 of file global.c.

◆ MainScrol

GtkWidget* MainScrol[2]

extern

Definition at line 207 of file global.c.

◆ MainView

GtkWidget* MainView

extern

Definition at line 202 of file global.c.

◆ MainWindow

GtkWidget* MainWindow

extern

Definition at line 201 of file global.c.

◆ mode_name

gchar* mode_name[2]

extern

Definition at line 137 of file global.c.

◆ mol_update

int mol_update

extern

Definition at line 171 of file global.c.

◆ newspace

gboolean newspace

extern

Definition at line 181 of file global.c.

◆ nprojects

int nprojects

extern

Definition at line 158 of file global.c.

◆ object_motion

gboolean object_motion

extern

Definition at line 186 of file global.c.

◆ OGL

GdkPixbuf* OGL

extern

Definition at line 221 of file global.c.

◆ OGLC

GdkPixbuf* OGLC

extern

Definition at line 223 of file global.c.

◆ OGLM

GdkPixbuf* OGLM

extern

Definition at line 222 of file global.c.

◆ opac

double opac

extern

Definition at line 194 of file global.c.

◆ opengl_project

project* opengl_project

extern

Definition at line 54 of file project.c.

◆ PACKAGE_AN

gchar* PACKAGE_AN

extern

Definition at line 93 of file global.c.

◆ PACKAGE_BD

gchar* PACKAGE_BD

extern

Definition at line 92 of file global.c.

◆ PACKAGE_BMP

gchar* PACKAGE_BMP

extern

Definition at line 87 of file global.c.

◆ PACKAGE_CH

gchar* PACKAGE_CH

extern

Definition at line 95 of file global.c.

◆ PACKAGE_CON

gchar* PACKAGE_CON

extern

Definition at line 80 of file global.c.

◆ PACKAGE_DFAN

gchar* PACKAGE_DFAN

extern

Definition at line 117 of file global.c.

◆ PACKAGE_DFBD

gchar* PACKAGE_DFBD

extern

Definition at line 116 of file global.c.

◆ PACKAGE_DFDI

gchar* PACKAGE_DFDI

extern

Definition at line 118 of file global.c.

◆ PACKAGE_DFIN

gchar* PACKAGE_DFIN

extern

Definition at line 120 of file global.c.

◆ PACKAGE_DFTD

gchar* PACKAGE_DFTD

extern

Definition at line 119 of file global.c.

◆ PACKAGE_DOTA

gchar* PACKAGE_DOTA

extern

Definition at line 108 of file global.c.

◆ PACKAGE_DOTB

gchar* PACKAGE_DOTB

extern

Definition at line 109 of file global.c.

◆ PACKAGE_DOTC

gchar* PACKAGE_DOTC

extern

Definition at line 110 of file global.c.

◆ PACKAGE_DOTD

gchar* PACKAGE_DOTD

extern

Definition at line 111 of file global.c.

◆ PACKAGE_DOTE

gchar* PACKAGE_DOTE

extern

Definition at line 112 of file global.c.

◆ PACKAGE_DOTF

gchar* PACKAGE_DOTF

extern

Definition at line 113 of file global.c.

◆ PACKAGE_DOTG

gchar* PACKAGE_DOTG

extern

Definition at line 114 of file global.c.

◆ PACKAGE_DOTH

gchar* PACKAGE_DOTH

extern

Definition at line 115 of file global.c.

◆ PACKAGE_EPS

gchar* PACKAGE_EPS

extern

Definition at line 84 of file global.c.

◆ PACKAGE_GR

gchar* PACKAGE_GR

extern

Definition at line 90 of file global.c.

◆ PACKAGE_IMG

gchar* PACKAGE_IMG

extern

Definition at line 81 of file global.c.

◆ PACKAGE_IMP

gchar* PACKAGE_IMP

extern

Definition at line 79 of file global.c.

◆ PACKAGE_JPG

gchar* PACKAGE_JPG

extern

Definition at line 86 of file global.c.

◆ PACKAGE_LABOUT

gchar* PACKAGE_LABOUT

extern

Definition at line 107 of file global.c.

◆ PACKAGE_LAGPL

gchar* PACKAGE_LAGPL

extern

Definition at line 106 of file global.c.

◆ PACKAGE_LIB_DIR

gchar* PACKAGE_LIB_DIR

extern

Definition at line 78 of file global.c.

◆ PACKAGE_LOGO

gchar* PACKAGE_LOGO

extern

Definition at line 105 of file global.c.

◆ PACKAGE_MOL

gchar* PACKAGE_MOL

extern

Definition at line 99 of file global.c.

◆ PACKAGE_MS

gchar* PACKAGE_MS

extern

Definition at line 97 of file global.c.

◆ PACKAGE_OGL

gchar* PACKAGE_OGL

extern

Definition at line 100 of file global.c.

◆ PACKAGE_OGLC

gchar* PACKAGE_OGLC

extern

Definition at line 102 of file global.c.

◆ PACKAGE_OGLM

gchar* PACKAGE_OGLM

extern

Definition at line 101 of file global.c.

◆ PACKAGE_PDF

gchar* PACKAGE_PDF

extern

Definition at line 82 of file global.c.

◆ PACKAGE_PNG

gchar* PACKAGE_PNG

extern

Definition at line 85 of file global.c.

◆ PACKAGE_PRO

gchar* PACKAGE_PRO

extern

Definition at line 103 of file global.c.

◆ PACKAGE_RI

gchar* PACKAGE_RI

extern

Definition at line 94 of file global.c.

◆ PACKAGE_SET

gchar* PACKAGE_SET

extern

Definition at line 104 of file global.c.

◆ PACKAGE_SGCF

gchar* PACKAGE_SGCF

extern

Definition at line 123 of file global.c.

◆ PACKAGE_SGCI

gchar* PACKAGE_SGCI

extern

Definition at line 122 of file global.c.

◆ PACKAGE_SGCP

gchar* PACKAGE_SGCP

extern

Definition at line 121 of file global.c.

◆ PACKAGE_SGHP

gchar* PACKAGE_SGHP

extern

Definition at line 124 of file global.c.

◆ PACKAGE_SGMI

gchar* PACKAGE_SGMI

extern

Definition at line 133 of file global.c.

◆ PACKAGE_SGMP

gchar* PACKAGE_SGMP

extern

Definition at line 132 of file global.c.

◆ PACKAGE_SGOC

gchar* PACKAGE_SGOC

extern

Definition at line 130 of file global.c.

◆ PACKAGE_SGOF

gchar* PACKAGE_SGOF

extern

Definition at line 131 of file global.c.

◆ PACKAGE_SGOI

gchar* PACKAGE_SGOI

extern

Definition at line 129 of file global.c.

◆ PACKAGE_SGOP

gchar* PACKAGE_SGOP

extern

Definition at line 128 of file global.c.

◆ PACKAGE_SGTC

gchar* PACKAGE_SGTC

extern

Definition at line 134 of file global.c.

◆ PACKAGE_SGTI

gchar* PACKAGE_SGTI

extern

Definition at line 126 of file global.c.

◆ PACKAGE_SGTP

gchar* PACKAGE_SGTP

extern

Definition at line 127 of file global.c.

◆ PACKAGE_SGTR

gchar* PACKAGE_SGTR

extern

Definition at line 125 of file global.c.

◆ PACKAGE_SP

gchar* PACKAGE_SP

extern

Definition at line 96 of file global.c.

◆ PACKAGE_SQ

gchar* PACKAGE_SQ

extern

Definition at line 91 of file global.c.

◆ PACKAGE_SVG

gchar* PACKAGE_SVG

extern

Definition at line 83 of file global.c.

◆ PACKAGE_TD

gchar* PACKAGE_TD

extern

Definition at line 98 of file global.c.

◆ PACKAGE_TIFF

gchar* PACKAGE_TIFF

extern

Definition at line 88 of file global.c.

◆ PACKAGE_VOID

gchar* PACKAGE_VOID

extern

Definition at line 89 of file global.c.

◆ pasted_todo

int* pasted_todo

extern

Definition at line 174 of file global.c.

◆ periodic_table_info

element_data periodic_table_info[]

extern

Definition at line 71 of file w_library.c.

◆ pi

double pi

extern

Definition at line 195 of file global.c.

◆ pop

GtkWidget* pop

extern

Definition at line 204 of file global.c.

◆ progressbar

GtkWidget* progressbar

extern

Definition at line 206 of file global.c.

◆ proj

project* proj

extern

◆ projfile

gchar* projfile

extern

Definition at line 140 of file global.c.

◆ reading_input

gboolean reading_input

extern

Definition at line 182 of file global.c.

◆ register_button

GtkWidget* register_button

extern

Definition at line 211 of file global.c.

◆ rings_type

char* rings_type[5]

extern

Definition at line 143 of file global.c.

◆ RUN

GdkPixbuf* RUN

extern

Definition at line 224 of file global.c.

◆ selected_status

gboolean selected_status

extern

Definition at line 187 of file global.c.

◆ SETTING

GdkPixbuf* SETTING

extern

Definition at line 219 of file global.c.

◆ SETTINGS

GdkPixbuf* SETTINGS

extern

Definition at line 220 of file global.c.

◆ silent_input

gboolean silent_input

extern

Definition at line 188 of file global.c.

◆ start_time

struct timespec start_time

extern

Definition at line 191 of file global.c.

◆ statusbar

GtkStatusbar* statusbar

extern

Definition at line 214 of file global.c.

◆ statusval

int statusval

extern

Definition at line 164 of file global.c.

◆ std

ColRGBA std[6]

extern

Definition at line 147 of file gui.c.

◆ stop_time

struct timespec stop_time

extern

Definition at line 192 of file global.c.

◆ tag

GtkTextTag* tag

extern

Definition at line 213 of file global.c.

◆ THEBD

GdkPixbuf* THEBD

extern

Definition at line 218 of file global.c.

◆ THEMO

GdkPixbuf* THEMO

extern

Definition at line 217 of file global.c.

◆ THETD

GdkPixbuf* THETD

extern

Definition at line 216 of file global.c.

◆ tmp_adv_bonding

gboolean tmp_adv_bonding[2]

extern

Definition at line 183 of file global.c.

◆ tmp_pixels

int tmp_pixels[2]

extern

Definition at line 173 of file global.c.

◆ untime

char* untime[6]

extern

Definition at line 149 of file global.c.

◆ workspacefile

gchar* workspacefile

extern

Definition at line 156 of file global.c.

◆ workzone

workspace workzone

extern

Definition at line 46 of file project.c.

◆ xsk

double* xsk

extern

Definition at line 176 of file global.c.

Data Structures

Macros

Typedefs

Enumerations

Functions

Variables

Detailed Description

Macro Definition Documentation

◆ ABOUT

◆ AFILE

◆ AN

◆ APPLY

◆ ATOM_LIMIT

◆ BD

◆ BSEP

◆ BV

◆ CANCEL

◆ CH

◆ CHEM_M

◆ CHEM_N

◆ CHEM_PARAMS

◆ CHEM_R

◆ CHEM_X

◆ CHEM_Z

◆ DEFAULT_ALPHA

◆ DEFAULT_FONT_SIZE

◆ DELETEB

◆ DIAL_ERROR

◆ DPROPERTIES

◆ ECUT

◆ EDITA

◆ EDITC

◆ EDITF

◆ ERROR_ATOM_A

◆ ERROR_ATOM_B

◆ ERROR_CHAINS

◆ ERROR_COORD

◆ ERROR_CURVE

◆ ERROR_IMAGE

◆ ERROR_MOL

◆ ERROR_NO_WAY

◆ ERROR_PROJECT

◆ ERROR_RINGS

◆ ERROR_RW

◆ ERROR_UPDATE

◆ EXECUTE

◆ FCLOSE

◆ FEXIT

◆ FF

◆ FITBEST

◆ FNEW

◆ FOPEN

◆ FSAVE

◆ FSAVEAS

◆ FULLSCREEN

◆ GDK_SYNCHRONIZE

◆ GK

◆ GLOBAL_H_

◆ GO_DOWN

◆ GO_LEFT

◆ GO_RIGHT

◆ GO_UP

◆ GR

◆ IODEBUG

◆ LINE_SIZE

◆ LIST_ADD

◆ LIST_REM

◆ max

◆ MAXDATA

◆ MAXDATC

◆ MEDIA_FAST

◆ MEDIA_FIRST

◆ MEDIA_GOTO

◆ MEDIA_LAST

◆ MEDIA_LOOP

◆ MEDIA_NEXT

◆ MEDIA_PLAY

◆ MEDIA_PREV

◆ MEDIA_SLOW

◆ MEDIA_STOP