BALL: FDPBDialog.h Source File

00001 // -*- Mode: C++; tab-width: 2; -*-
00002 // vi: set ts=2:
00003 //
00004 #ifndef BALL_VIEW_DIALOGS_FDPBDIALOG_H
00005 #define BALL_VIEW_DIALOGS_FDPBDIALOG_H
00006 
00007 #ifndef BALL_COMMON_GLOBAL_H
00008 # include <BALL/COMMON/global.h>
00009 #endif
00010 
00011 #ifndef BALL_VIEW_KERNEL_MODULARWIDGET_H
00012 # include <BALL/VIEW/KERNEL/modularWidget.h>
00013 #endif
00014 
00015 #ifndef BALL_VIEW_KERNEL_PREFERENCESENTRY
00016 # include <BALL/VIEW/KERNEL/preferencesEntry.h>
00017 #endif
00018 
00019 #ifndef BALL_SOLVATION_POISSONBOLTZMANN_H
00020 # include <BALL/SOLVATION/poissonBoltzmann.h>
00021 #endif
00022 
00023 #ifndef BALL_MOLMEC_COMMON_RADIUSRULEPROCESSOR_H
00024 # include <BALL/MOLMEC/COMMON/radiusRuleProcessor.h>
00025 #endif
00026 
00027 #ifndef BALL_MOLMEC_COMMON_CHARGERULEPROCESSOR_H
00028 # include <BALL/MOLMEC/COMMON/chargeRuleProcessor.h>
00029 #endif
00030 
00031 #ifndef BALL_STRUCTURE_DEFAULTPROCESSORS_H
00032 # include <BALL/STRUCTURE/defaultProcessors.h>
00033 #endif
00034 
00035 #include <BALL/VIEW/UIC/ui_FDPBDialog.h>
00036 
00037 class QLineEdit;
00038 
00039 namespace BALL
00040 {
00041   namespace VIEW
00042   {
00043 
00044     class CalculateFDPBThread;
00045 
00049     class BALL_VIEW_EXPORT FDPBDialog 
00050       : public QDialog,
00051         public Ui_FDPBDialogData,
00052         public ModularWidget,
00053         public PreferencesEntry
00054     { 
00055       friend class CalculateFDPBThread;
00056 
00057       Q_OBJECT
00058 
00059       public:
00060       
00061       BALL_EMBEDDABLE(FDPBDialog,ModularWidget)
00062 
00063       
00064       FDPBDialog(QWidget* parent = 0, const char* name = "FDPBDialog",
00065                  bool modal = FALSE, Qt::WFlags fl = 0);
00066 
00068       virtual ~FDPBDialog();
00069         
00071       bool calculate();
00072 
00074       FDPB& getFDPBSolver()
00075         {return fdpb_;}
00076 
00078       void setSystem(System* system)
00079         {system_ = system;}
00080 
00082       System* getSystem()
00083         { return system_;}
00084       
00085 
00086     public slots:
00087 
00089       virtual void browseChargesData();
00090 
00092       virtual void browseChargesRules();
00093 
00095       virtual void browseRadiiData();
00096 
00098       virtual void browseRadiiRules();
00099 
00101       virtual void accept();
00102 
00104       virtual void resetPressed();
00105 
00106     protected slots:
00107       virtual void clicked(QAbstractButton* button);
00108 
00109     protected:
00110 
00111       void calculate_();
00112       void selectFile_(QLineEdit& lineedit);
00113       void applyValues_();
00114       bool applyProcessors_();
00115 
00116       FDPB      fdpb_;
00117       Options   options_;
00118       System*   system_;
00119       
00120       RadiusRuleProcessor       radius_rule_processor_;
00121       ChargeRuleProcessor       charge_rule_processor_;
00122       AssignRadiusProcessor     radius_processor_;
00123       AssignChargeProcessor     charge_processor_;
00124       CalculateFDPBThread*      thread_;
00125     };
00126 
00127 } } // Namespaces
00128 #endif