hamolsetdoc.h

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#if !defined(HAMOLSETDOC_H)
#define HAMOLSETDOC_H

class HaMolSet;

class HaMolSetDoc : public CDocument
{
        friend class MolSetParDlg;
public: // create from serialization only
        HaMolSetDoc();
        HaMolSetDoc(HaMolSet* new_pmset);
        DECLARE_DYNCREATE(HaMolSetDoc)

public:
    int to_delete_mset; 
    
        HaMolSet* pmset; 
// Operations
public:

// Overrides
        // ClassWizard generated virtual function overrides
        //{{AFX_VIRTUAL(HaMolSetDoc)
        public:
        virtual BOOL OnNewDocument();
        virtual BOOL OnOpenDocument(LPCTSTR lpszPathName);
        virtual void DeleteContents();
        //}}AFX_VIRTUAL

// Implementation
public:
        virtual ~HaMolSetDoc();

// Debug Control 

        enum DEBUG_FLAG_PARAMS { file_reading_debug = 0x0001 };

        int debug_flag;

protected:
        void InitDocument();

// Generated message map functions
protected:
        //{{AFX_MSG(HaMolSetDoc)
        afx_msg void OnAddHydrogens();
        afx_msg void OnAddHHybrid();
        afx_msg void OnTania1();
        afx_msg void OnAddMissingAtoms();
        afx_msg void OnMolSave();
        afx_msg void OnMolSaveAs();
        afx_msg void OnResetETModule();
        afx_msg void DoEditFragmDialog();
        afx_msg void DoDelphiDialog();
        afx_msg void DoLoadQCDatDialog();
        afx_msg void DoEditGroupsDialog();
        afx_msg void DoEditGeomDialog();
        afx_msg void DoMolSetParamDialog();
        afx_msg void DoETEffHamDialog();
        afx_msg void DoQChemParamDialog();
        afx_msg void DoWaveFunAnalDialog();
        afx_msg void DoPathwaysDialog();
        afx_msg void DoBuildFilmDialog();
        afx_msg void DoMolMechDialog();
        afx_msg void DoNuclAcidDialog();
        afx_msg void DoInterMolDialog();
        afx_msg void DoScatterDialog();
        afx_msg void OnEditAtomParam();
        afx_msg void OnAddPolarHydrogens();
        afx_msg void OnFindHbonds();
        afx_msg void OnMishaMenu();
        afx_msg void OnCalcTMatr1();
        afx_msg void DoSolvateDialog();
        afx_msg void OnTestMap();
        afx_msg void OnClearPicked();
        afx_msg void OnDelSelAtoms();
        afx_msg void OnEditRedox();
        //}}AFX_MSG
public:
        afx_msg void DoAtomParamsDialog();
        afx_msg void DoDNAIntCoordDialog();
        afx_msg void DoResidueParamsDialog();
public:
        afx_msg void OnRenumberGrp();

        DECLARE_MESSAGE_MAP()

};

#endif // end if !defined(HAMOLSETDOC_H)

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