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Showing content from http://www.ncbi.nlm.nih.gov/IEB/ToolBox/CPP_DOC/doxyhtml/classCBiostruc__graph__Base.html below:

NCBI C++ ToolKit: CBiostruc_graph_Base Class Reference

A biostruc graph contains the complete chemical graph of the biomolecular assembly. More...

  CBiostruc_graph_Base (void)   virtual  ~CBiostruc_graph_Base (void)     DECLARE_INTERNAL_TYPE_INFO ()   bool  IsSetDescr (void) const   Check if a value has been assigned to Descr data member. More...
  bool  CanGetDescr (void) const   Check if it is safe to call GetDescr method. More...
  void  ResetDescr (void)   Reset Descr data member. More...
  const TDescrGetDescr (void) const   Get the Descr member data. More...
  TDescrSetDescr (void)   Assign a value to Descr data member. More...
  bool  IsSetMolecule_graphs (void) const   Check if a value has been assigned to Molecule_graphs data member. More...
  bool  CanGetMolecule_graphs (void) const   Check if it is safe to call GetMolecule_graphs method. More...
  void  ResetMolecule_graphs (void)   Reset Molecule_graphs data member. More...
  const TMolecule_graphsGetMolecule_graphs (void) const   Get the Molecule_graphs member data. More...
  TMolecule_graphsSetMolecule_graphs (void)   Assign a value to Molecule_graphs data member. More...
  bool  IsSetInter_molecule_bonds (void) const   Check if a value has been assigned to Inter_molecule_bonds data member. More...
  bool  CanGetInter_molecule_bonds (void) const   Check if it is safe to call GetInter_molecule_bonds method. More...
  void  ResetInter_molecule_bonds (void)   Reset Inter_molecule_bonds data member. More...
  const TInter_molecule_bondsGetInter_molecule_bonds (void) const   Get the Inter_molecule_bonds member data. More...
  TInter_molecule_bondsSetInter_molecule_bonds (void)   Assign a value to Inter_molecule_bonds data member. More...
  bool  IsSetResidue_graphs (void) const   Check if a value has been assigned to Residue_graphs data member. More...
  bool  CanGetResidue_graphs (void) const   Check if it is safe to call GetResidue_graphs method. More...
  void  ResetResidue_graphs (void)   Reset Residue_graphs data member. More...
  const TResidue_graphsGetResidue_graphs (void) const   Get the Residue_graphs member data. More...
  TResidue_graphsSetResidue_graphs (void)   Assign a value to Residue_graphs data member. More...
  virtual void  Reset (void)   Reset the whole object. More...
    CSerialObject (void)   virtual  ~CSerialObject (void)   virtual const CTypeInfoGetThisTypeInfo (void) const =0   virtual void  Assign (const CSerialObject &source, ESerialRecursionMode how=eRecursive)   Set object to copy of another one. More...
  virtual bool  Equals (const CSerialObject &object, ESerialRecursionMode how=eRecursive) const   Check if both objects contain the same values. More...
  virtual void  DebugDump (CDebugDumpContext ddc, unsigned int depth) const   Define method for dumping debug information. More...
  void  ThrowUnassigned (TMemberIndex index) const   void  ThrowUnassigned (TMemberIndex index, const char *file_name, int file_line) const   bool  HasNamespaceName (void) const   Check if object data type has namespace name. More...
  const stringGetNamespaceName (void) const   Get namespace name. More...
  bool  HasNamespacePrefix (void) const   Check if data type has namespace prefix. More...
  const stringGetNamespacePrefix (void) const   Get namespace prefix. More...
    CObject (void)   Constructor. More...
    CObject (const CObject &src)   Copy constructor. More...
  virtual  ~CObject (void)   Destructor. More...
  CObjectoperator= (const CObject &src) THROWS_NONE   Assignment operator. More...
  bool  CanBeDeleted (void) const THROWS_NONE   Check if object can be deleted. More...
  bool  IsAllocatedInPool (void) const THROWS_NONE   Check if object is allocated in memory pool (not system heap) More...
  bool  Referenced (void) const THROWS_NONE   Check if object is referenced. More...
  bool  ReferencedOnlyOnce (void) const THROWS_NONE   Check if object is referenced only once. More...
  void  AddReference (void) const   Add reference to object. More...
  void  RemoveReference (void) const   Remove reference to object. More...
  void  ReleaseReference (void) const   Remove reference without deleting object. More...
  virtual void  DoNotDeleteThisObject (void)   Mark this object as not allocated in heap – do not delete this object. More...
  virtual void  DoDeleteThisObject (void)   Mark this object as allocated in heap – object can be deleted. More...
  void *  operator new (size_t size)   Define new operator for memory allocation. More...
  void *  operator new[] (size_t size)   Define new[] operator for 'array' memory allocation. More...
  void  operator delete (void *ptr)   Define delete operator for memory deallocation. More...
  void  operator delete[] (void *ptr)   Define delete[] operator for memory deallocation. More...
  void *  operator new (size_t size, void *place)   Define new operator. More...
  void  operator delete (void *ptr, void *place)   Define delete operator. More...
  void *  operator new (size_t size, CObjectMemoryPool *place)   Define new operator using memory pool. More...
  void  operator delete (void *ptr, CObjectMemoryPool *place)   Define delete operator. More...
    CDebugDumpable (void)   virtual  ~CDebugDumpable (void)   void  DebugDumpText (ostream &out, const string &bundle, unsigned int depth) const   void  DebugDumpFormat (CDebugDumpFormatter &ddf, const string &bundle, unsigned int depth) const   void  DumpToConsole (void) const  

A biostruc graph contains the complete chemical graph of the biomolecular assembly.

The assembly graph is defined hierarchically, in terms of subgraphs graphs of component molecules. For PDB-derived biostrucs, the molecules forming the assembly are the individual biopolymer chains and any non-polymer or "heterogen" groups which are present. The PDB-derived "compound name" field appears as the name within the biostruc-graph description. PDB "class" and "source" fields appear as explicit attributes. PDB-derived structures are assigned an assembly type of "other" unless they have been further classified as the "physiological form" or "crystallographic cell" contents. If they have, the source of the type classification appears as a citation within the assembly description. Note that the biostruc-graph also includes as literals the subgraphs of any nonstandard residues present within it. For PDB-derived biostrucs these subgraphs are constructed automatically, with validation as described below.

CBiostruc_graph_Base

Definition at line 93 of file Biostruc_graph_.hpp.


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