kalzium/src/tools/moleculeview.h

   1 /***************************************************************************
   2     copyright            : (C) 2006 by Carsten Niehaus
   3     email                : cniehaus@kde.org
   4  ***************************************************************************/
   5
   6 /***************************************************************************
   7  *                                                                         *
   8  *   This program is free software; you can redistribute it and/or modify  *
   9  *   it under the terms of the GNU General Public License as published by  *
  10  *   the Free Software Foundation; either version 2 of the License, or     *
  11  *   (at your option) any later version.                                   *
  12  *                                                                         *
  13  ***************************************************************************/
  14 #ifndef MOLECULEVIEW_H
  15 #define MOLECULEVIEW_H
  16
  17 #include <kdialog.h>
  18
  19 #include "ui_moleculeviewerwidget.h"
  20
  21 #include <openbabel/mol.h>
  22 #include <openbabel/obiter.h>
  23
  24 /**
  25  * @author Carsten Niehaus
  26  */
  27 class MoleculeDialog : public KDialog
  28 {
  29         Q_OBJECT
  30
  31         public:
  32                 MoleculeDialog( QWidget  * parent );
  33                 ~MoleculeDialog();
  34
  35         private:
  36                 QString  m_path;///to store the path were the molecules are located
  37                 KDialog *m_helpWindow;
  38
  39                 Ui::moleculeViewerForm ui;
  40
  41                 /**
  42                  * Update the statistical information about the current molecule
  43                  */
  44                 void updateStatistics();
  45
  46         private slots:
  47                 /**
  48                  * Load a molecule
  49                  */
  50                 void slotLoadMolecule();
  51
  52                 /**
  53                  * Get a new molecule using hot new stuff
  54                  */
  55                 void slotDownloadNewStuff();
  56
  57                 void slotHelp();
  58 };
  59
  60 #endif // MOLECULEVIEW_H