m_bonds.c

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/* This file is part of the 'atomes' software
 
'atomes' is free software: you can redistribute it and/or modify it under the terms
of the GNU Affero General Public License as published by the Free Software Foundation,
either version 3 of the License, or (at your option) any later version.
 
'atomes' is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY;
without even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.
See the GNU General Public License for more details.
 
You should have received a copy of the GNU Affero General Public License along with 'atomes'.
If not, see <https://www.gnu.org/licenses/>
 
Copyright (C) 2022-2026 by CNRS and University of Strasbourg */

 
/*
* This file: 'm_bonds.c'
*
* Contains:
*
 
 - The functions to create the 'Model -> Bond(s)' submenu
 
*
* List of functions:
 
  gchar * label_cutrab (project * this_proj, glwin * view, int id);
 
  GtkWidget * create_bond_menu_item (gchar * str, GtkWidget * menu);
  GtkWidget * create_bond_layout_widget (gchar * str, GtkWidget * widg, int va, tint * data);
  GtkWidget * menu_bonds (glwin * view, int id, int at);
 
  GMenu * create_bond_layout_section (glwin * view, gchar * str, gchar * key, int popm, int id, GCallback handler, gpointer data, gboolean sensitive);
  GMenu * menu_bonds (glwin * view, int popm, int at);
 
*/
 
#include "global.h"
#include "glview.h"
#include "glwindow.h"
 
#ifdef GTK4
extern G_MODULE_EXPORT void window_bonds (GSimpleAction * action, GVariant * parameter, gpointer data);
extern G_MODULE_EXPORT void window_cuts (GSimpleAction * action, GVariant * parameter, gpointer data);
extern G_MODULE_EXPORT void set_bond_parameter (GSimpleAction * action, GVariant * parameter, gpointer data);
#else
extern G_MODULE_EXPORT void window_bonds (GtkWidget * widg, gpointer data);
extern G_MODULE_EXPORT void window_cuts (GtkWidget * widg, gpointer data);
extern G_MODULE_EXPORT void set_bond_parameter (GtkWidget * widg, gpointer data);
#endif

gchar * label_cutrab (project * this_proj, glwin * view, int id)
{
  int i, j, k, m;
  gchar * mot;
  gchar * tmp;
  gchar * str;
  chemical_data * chem = this_proj -> chemistry;
 
  k = 0;
  m = this_proj -> nspec;
  for (i=0; i < m; i++)
  {
    if (id == 0)
    {
      str = g_strdup_printf ("%s-%s [ %f Å ]", chem -> label[i], chem -> label[i], chem -> cutoffs[i][i]);
    }
    else
    {
      if (id == 1)
      {
        str = g_strdup_printf ("%s-%s [ %f Å ]", chem -> label[i], chem -> label[i], view -> anim -> last -> img -> bondrad[i][i]);
      }
      else if (id == 2)
      {
        str = g_strdup_printf ("%s-%s [ %f Å ]", chem -> label[i], chem -> label[i], view -> anim -> last -> img -> bondrad[i+m][i+m]);
      }
      else if (id == 3)
      {
        str = g_strdup_printf ("%s-%s [ %f pts ]", chem -> label[i], chem -> label[i], view -> anim -> last -> img -> linerad[i][i]);
      }
      else
      {
        str = g_strdup_printf ("%s-%s [ %f pts ]", chem -> label[i], chem -> label[i], view -> anim -> last -> img -> linerad[i+m][i+m]);
      }
    }
    if (i == 0)
    {
      mot = g_strdup_printf ("%s", str);
    }
    else
    {
      tmp = g_strdup_printf ("%s", mot);
      g_free (mot);
      mot = g_strdup_printf ("%s\n%s", tmp, str);
      g_free (tmp);
    }
    g_free (str);
    k+=1;
  }
  for (i=0; i < m-1; i++)
  {
    for (j=i+1; j < m; j++)
    {
      if (id == 0)
      {
        str = g_strdup_printf ("%s-%s [ %f Å ]", chem -> label[i], chem -> label[j], chem -> cutoffs[i][j]);
      }
      else
      {
        if (id == 1)
        {
          str = g_strdup_printf ("%s-%s [ %f Å ]", chem -> label[i], chem -> label[j], view -> anim -> last -> img -> bondrad[i][j]);
        }
        else if (id == 2)
        {
          str = g_strdup_printf ("%s-%s [ %f Å ]", chem -> label[i], chem -> label[j], view -> anim -> last -> img -> bondrad[i+m][j+m]);
        }
        else if (id == 3)
        {
          str = g_strdup_printf ("%s-%s [ %f pts ]", chem -> label[i], chem -> label[j], view -> anim -> last -> img -> linerad[i][j]);
        }
        else
        {
          str = g_strdup_printf ("%s-%s [ %f pts ]", chem -> label[i], chem -> label[j], view -> anim -> last -> img -> linerad[i+m][j+m]);
        }
      }
 
      if (k == 0)
      {
        mot = g_strdup_printf ("%s", str);
      }
      else
      {
        tmp = g_strdup_printf ("%s", mot);
        g_free (mot);
        mot = g_strdup_printf ("%s\n%s", tmp, str);
        g_free (tmp);
      }
      g_free (str);
      k += 1;
    }
  }
  if (id == 0)
  {
    str = g_strdup_printf (_("Total [ %f Å ]"), chem -> grtotcutoff);
    tmp = g_strdup_printf ("%s", mot);
    g_free (mot);
    mot = g_strdup_printf ("%s\n%s", tmp, str);
    g_free (tmp);
    g_free (str);
  }
  return mot;
}
 
#ifdef GTK3
GtkWidget * create_bond_menu_item (gchar * str, GtkWidget * menu)
{
  GtkWidget * layout = create_menu_item (FALSE, str);
  gtk_menu_shell_append ((GtkMenuShell *)menu, layout);
  return  layout;
}

GtkWidget * create_bond_layout_widget (gchar * str, GtkWidget * widg, int va, tint * data)
{
  GtkWidget * menu = gtk_menu_new ();
  gtk_menu_item_set_submenu ((GtkMenuItem *)widg, menu);
  GtkWidget * layout = create_menu_item (FALSE, str);
  gtk_menu_shell_append ((GtkMenuShell *)menu, layout);
  switch (va)
  {
    case 0:
      g_signal_connect (G_OBJECT (layout), "activate", G_CALLBACK(window_bonds), data);
      break;
    case 1:
      g_signal_connect (G_OBJECT (layout), "activate", G_CALLBACK(set_bond_parameter), data);
      break;
    default:
      g_signal_connect (G_OBJECT (layout), "activate", G_CALLBACK(window_cuts), data);
      break;
  }
  return layout;
}

GtkWidget * menu_bonds (glwin * view, int id, int at)
{
  GtkWidget * widg;
  gchar * str;
  int i;
 
  GtkWidget * menub = gtk_menu_new ();
  i = view -> anim -> last -> img -> style;
  if (id == 0)
  {
    if (at == 0)
    {
      str = g_strdup_printf (_("Cylinder(s) [ %f Å ]"), view -> anim -> last -> img -> radall[0]);
    }
    else
    {
      str = g_strdup_printf (_("Cylinder(s) [ %f Å ]"), view -> anim -> last -> img -> radall[1]);
    }
    view -> ogl_bonds[8*at] = create_bond_menu_item (_("Radius"), menub);
    view -> ogl_bonds[1+8*at] = create_bond_layout_widget (str, view -> ogl_bonds[8*at], 0, & view -> colorp[2+at][0]);
    g_free (str);
    if (at == 1 && ! view -> anim -> last -> img -> draw_clones)
    {
      widget_set_sensitive (view -> ogl_bonds[1+8*at], 0);
    }
  }
  else if (i == CYLINDERS)
  {
    if (at == 0)
    {
      str = g_strdup_printf (_("Cylinder(s) [ %f Å ]"), view -> anim -> last -> img -> radall[0]);
    }
    else
    {
      str = g_strdup_printf (_("Cylinder(s) [ %f Å ]"), view -> anim -> last -> img -> radall[1]);
    }
    widg = create_bond_menu_item (_("Cylinder Radius(ii)"), menub);
    widg = create_bond_layout_widget (str, widg, 0, & view -> colorp[2+at][0]);
    g_free (str);
    if (at == 1 && ! view -> anim -> last -> img -> draw_clones)
    {
      widget_set_sensitive (widg, 0);
    }
  }
 
  if (id == 0)
  {
    str = label_cutrab (get_project_by_id(view -> proj), view, 1+at);
    view -> ogl_bonds[2+8*at] = create_bond_menu_item (_("Radius(ii)"), menub);
    view -> ogl_bonds[3+8*at] = create_bond_layout_widget (str, view -> ogl_bonds[2+8*at], 1, & view -> colorp[at][0]);
    g_free (str);
    if (at == 1 && ! view -> anim -> last -> img -> draw_clones)
    {
      widget_set_sensitive (view -> ogl_bonds[3+8*at], 0);
    }
  }
  else if (i == BALL_AND_STICK)
  {
    str = label_cutrab (get_project_by_id(view -> proj), view, 1+at);
    widg = create_bond_menu_item (_("Radius(ii)"), menub);
    widg = create_bond_layout_widget (str, widg, 1, & view -> colorp[at][0]);
    g_free (str);
    if (at == 1 && ! view -> anim -> last -> img -> draw_clones)
    {
      widget_set_sensitive (widg, 0);
    }
  }
 
  if (id == 0)
  {
    str = label_cutrab (get_project_by_id(view -> proj), view, 3+at);
    view -> ogl_bonds[4+8*at] = create_bond_menu_item (_("Line Width(s)"), menub);
    view -> ogl_bonds[5+8*at] = create_bond_layout_widget (str, view -> ogl_bonds[4+8*at], 1, & view -> colorp[at][1]);
    g_free (str);
    if (at == 1 && ! view -> anim -> last -> img -> draw_clones)
    {
      widget_set_sensitive (view -> ogl_bonds[5+8*at], 0);
    }
  }
  else if (i == WIREFRAME)
  {
    str = label_cutrab (get_project_by_id(view -> proj), view, 3+at);
    widg = create_bond_menu_item (_("Line Width(s)"), menub);;
    widg = create_bond_layout_widget (str, widg, 1, & view -> colorp[at][1]);
    g_free (str);
    if (at == 1 && ! view -> anim -> last -> img -> draw_clones)
    {
      widget_set_sensitive (widg, 0);
    }
  }
 
  if (at == 0)
  {
    str = label_cutrab (get_project_by_id(view -> proj), view, 0);
    if (id == 0)
    {
      view -> ogl_bonds[6] = create_bond_menu_item (_("Cutoffs"), menub);
      view -> ogl_bonds[7] = create_bond_layout_widget (str, view -> ogl_bonds[6], 2, & view -> colorp[at][0]);
    }
    else
    {
      widg = create_bond_menu_item (_("Cutoffs"), menub);
      widg = create_bond_layout_widget (str, widg, 2, & view -> colorp[at][0]);
    }
    g_free (str);
  }
  return menub;
}
#else
GMenu * create_bond_layout_section (glwin * view, gchar * str, gchar * key, int popm, int id, GCallback handler, gpointer data, gboolean sensitive)
{
  GMenu * menu = g_menu_new ();
  append_opengl_item (view, menu, str, key, popm, id, NULL, IMG_NONE, NULL, FALSE, handler, data, FALSE, FALSE, FALSE, sensitive);
  return  menu;
}

GMenu * menu_bonds (glwin * view, int popm, int at)
{
  gchar * str;
  gboolean sensitive = (at == 1 && ! view -> anim -> last -> img -> draw_clones) ? FALSE : TRUE;
  GMenu * menu = g_menu_new ();
  switch (view -> anim -> last -> img -> style)
  {
    case CYLINDERS:
      if (at == 0)
      {
        str = g_strdup_printf (_("Cylinder(s) [ %f Å ]"), view -> anim -> last -> img -> radall[0]);
      }
      else
      {
        str = g_strdup_printf (_("Cylinder(s) [ %f Å ]"), view -> anim -> last -> img -> radall[1]);
      }
      append_submenu (menu, _("Cylinder Radius(ii)"), create_bond_layout_section (view, str, (at) ? "clone-cyl-rad" : "atom-cyl-rad", popm, at, G_CALLBACK(window_bonds), & view -> colorp[2+at][0], sensitive));
      g_free (str);
      break;
    case BALL_AND_STICK:
      str = label_cutrab (get_project_by_id(view -> proj), view, 1+at);
      append_submenu (menu, _("Radius(ii)"), create_bond_layout_section (view, str, (at) ? "clone-rad" : "atom-rad", popm, at+1, G_CALLBACK(set_bond_parameter), & view -> colorp[at][0], sensitive));
      g_free (str);
      break;
    case WIREFRAME:
      str = label_cutrab (get_project_by_id(view -> proj), view, 3+at);
      append_submenu (menu, _("Line Width(s)"), create_bond_layout_section (view, str, (at) ? "clone-line" : "atom-line", popm, at+2, G_CALLBACK(set_bond_parameter), & view -> colorp[at][1], sensitive));
      g_free (str);
      break;
  }
 
  if (! at)
  {
    str = label_cutrab (get_project_by_id(view -> proj), view, 0);
    append_submenu (menu, _("Cutoffs"), create_bond_layout_section (view, str, "bond-cutoffs", popm, at+3, G_CALLBACK(window_cuts), & view -> colorp[at][0], sensitive));
    g_free (str);
  }
  return menu;
}
#endif