FDPBDialog.h

Go to the documentation of this file.

// -*- Mode: C++; tab-width: 2; -*-
// vi: set ts=2:
//
#ifndef BALL_VIEW_DIALOGS_FDPBDIALOG_H
#define BALL_VIEW_DIALOGS_FDPBDIALOG_H

#ifndef BALL_COMMON_GLOBAL_H
# include <BALL/COMMON/global.h>
#endif

#ifndef BALL_VIEW_KERNEL_MODULARWIDGET_H
# include <BALL/VIEW/KERNEL/modularWidget.h>
#endif

#ifndef BALL_VIEW_KERNEL_PREFERENCESENTRY
# include <BALL/VIEW/KERNEL/preferencesEntry.h>
#endif

#ifndef BALL_SOLVATION_POISSONBOLTZMANN_H
# include <BALL/SOLVATION/poissonBoltzmann.h>
#endif

#ifndef BALL_MOLMEC_COMMON_RADIUSRULEPROCESSOR_H
# include <BALL/MOLMEC/COMMON/radiusRuleProcessor.h>
#endif

#ifndef BALL_MOLMEC_COMMON_CHARGERULEPROCESSOR_H
# include <BALL/MOLMEC/COMMON/chargeRuleProcessor.h>
#endif

#ifndef BALL_STRUCTURE_DEFAULTPROCESSORS_H
# include <BALL/STRUCTURE/defaultProcessors.h>
#endif

#include <BALL/VIEW/UIC/ui_FDPBDialog.h>

class QLineEdit;

namespace BALL
{
  namespace VIEW
  {

    class CalculateFDPBThread;

    class BALL_VIEW_EXPORT FDPBDialog 
      : public QDialog,
        public Ui_FDPBDialogData,
        public ModularWidget,
        public PreferencesEntry
    { 
      friend class CalculateFDPBThread;

      Q_OBJECT

      public:
      
      BALL_EMBEDDABLE(FDPBDialog,ModularWidget)

      
      FDPBDialog(QWidget* parent = 0, const char* name = "FDPBDialog",
                 bool modal = FALSE, Qt::WFlags fl = 0);

      virtual ~FDPBDialog();
        
      bool calculate();

      FDPB& getFDPBSolver()
        {return fdpb_;}

      void setSystem(System* system)
        {system_ = system;}

      System* getSystem()
        { return system_;}
      

    public slots:

      virtual void browseChargesData();

      virtual void browseChargesRules();

      virtual void browseRadiiData();

      virtual void browseRadiiRules();

      virtual void cancelPressed();

      virtual void okPressed();

      virtual void resetPressed();
      
    protected:

      void calculate_();
      void selectFile_(QLineEdit& lineedit);
      void applyValues_();
      bool applyProcessors_();

      FDPB      fdpb_;
      Options   options_;
      System*   system_;
      
      RadiusRuleProcessor       radius_rule_processor_;
      ChargeRuleProcessor       charge_rule_processor_;
      AssignRadiusProcessor     radius_processor_;
      AssignChargeProcessor     charge_processor_;
      CalculateFDPBThread*      thread_;
    };

} } // Namespaces
#endif