vtkBlueObeliskDataParser Class Reference

Fill a vtkBlueObeliskData container with data from the BODR XML dataset. More...

#include <vtkBlueObeliskDataParser.h>

Inherits vtkXMLParser.

Collaboration diagram for vtkBlueObeliskDataParser:

Public Types
typedef vtkXMLParser	Superclass

Public Member Functions
virtual int	IsA (const char *type)
vtkBlueObeliskDataParser *	NewInstance () const
virtual void	SetTarget (vtkBlueObeliskData *bodr)
virtual int	Parse ()
virtual int	Parse (const char *)
virtual int	Parse (const char *, unsigned int)

Static Public Member Functions
static int	IsTypeOf (const char *type)
static vtkBlueObeliskDataParser *	SafeDownCast (vtkObjectBase *o)
static vtkBlueObeliskDataParser *	New ()

Protected Types
enum	AtomValueType {   None = 0, AtomicNumber, Symbol, Name,   PeriodicTableBlock, ElectronicConfiguration, Family, Mass,   ExactMass, IonizationEnergy, ElectronAffinity, PaulingElectronegativity,   CovalentRadius, VDWRadius, DefaultColor, BoilingPoint,   MeltingPoint, Period, Group }

Protected Member Functions
virtual vtkObjectBase *	NewInstanceInternal () const
	vtkBlueObeliskDataParser ()
	~vtkBlueObeliskDataParser ()
void	StartElement (const char *name, const char **attr)
void	EndElement (const char *name)
void	CharacterDataHandler (const char *data, int length)
void	SetCurrentValue (const char *data, int length)
void	SetCurrentValue (const char *data)
void	NewAtomStarted (const char **attr)
void	NewAtomFinished ()
void	NewValueStarted (const char **attr)
void	NewValueFinished ()

Protected Attributes
vtkBlueObeliskData *	Target
bool	IsProcessingAtom
bool	IsProcessingValue
std::string	CharacterDataValueBuffer
enum vtkBlueObeliskDataParser::AtomValueType	CurrentValueType
int	CurrentAtomicNumber
vtkStdString *	CurrentSymbol
vtkStdString *	CurrentName
vtkStdString *	CurrentPeriodicTableBlock
vtkStdString *	CurrentElectronicConfiguration
vtkStdString *	CurrentFamily
float	CurrentMass
float	CurrentExactMass
float	CurrentIonizationEnergy
float	CurrentElectronAffinity
float	CurrentPaulingElectronegativity
float	CurrentCovalentRadius
float	CurrentVDWRadius
float	CurrentDefaultColor [3]
float	CurrentBoilingPoint
float	CurrentMeltingPoint
unsigned int	CurrentPeriod
unsigned int	CurrentGroup

Detailed Description

Fill a vtkBlueObeliskData container with data from the BODR XML dataset.

The Blue Obelisk Data Repository is a free, open repository of chemical information. This class extracts the BODR information into vtk arrays, which are stored in a vtkBlueObeliskData object.

Warning

The vtkBlueObeliskDataParser class should never need to be used directly. For convenient access to the BODR data, use vtkPeriodicTable. For access to the raw arrays produced by this parser, see the vtkBlueObeliskData class. A static vtkBlueObeliskData object is accessible via vtkPeriodicTable::GetBlueObeliskData().

See Also

vtkPeriodicTable vtkBlueObeliskData

Definition at line 50 of file vtkBlueObeliskDataParser.h.

Member Typedef Documentation

typedef vtkXMLParser vtkBlueObeliskDataParser::Superclass

Definition at line 53 of file vtkBlueObeliskDataParser.h.

Member Enumeration Documentation

enum vtkBlueObeliskDataParser::AtomValueType

protected

Enumerator
None
AtomicNumber
Symbol
Name
PeriodicTableBlock
ElectronicConfiguration
Family
Mass
ExactMass
IonizationEnergy
ElectronAffinity
PaulingElectronegativity
CovalentRadius
VDWRadius
DefaultColor
BoilingPoint
MeltingPoint
Period
Group

Definition at line 95 of file vtkBlueObeliskDataParser.h.

Constructor & Destructor Documentation

vtkBlueObeliskDataParser::vtkBlueObeliskDataParser ( )

protected

vtkBlueObeliskDataParser::~vtkBlueObeliskDataParser ( )

protected

Member Function Documentation

static int vtkBlueObeliskDataParser::IsTypeOf ( const char *  type )

static

virtual int vtkBlueObeliskDataParser::IsA ( const char *  type )

virtual

static vtkBlueObeliskDataParser* vtkBlueObeliskDataParser::SafeDownCast ( vtkObjectBase *  o )

static

virtual vtkObjectBase* vtkBlueObeliskDataParser::NewInstanceInternal ( ) const

protectedvirtual

vtkBlueObeliskDataParser* vtkBlueObeliskDataParser::NewInstance

(

)

const

static vtkBlueObeliskDataParser* vtkBlueObeliskDataParser::New ( )

static

virtual void vtkBlueObeliskDataParser::SetTarget ( vtkBlueObeliskData *  bodr )

virtual

Set the target vtkBlueObeliskData object that this parser will populate

virtual int vtkBlueObeliskDataParser::Parse ( )

virtual

Start parsing

virtual int vtkBlueObeliskDataParser::Parse ( const char *  )

virtual

These are only implemented to prevent compiler warnings about hidden virtual overloads. This function simply call Parse(); the arguments are ignored.

virtual int vtkBlueObeliskDataParser::Parse ( const char *  , unsigned  int  )

virtual

These are only implemented to prevent compiler warnings about hidden virtual overloads. This function simply call Parse(); the arguments are ignored.

void vtkBlueObeliskDataParser::StartElement ( const char *  name, const char **  attr  )

protected

void vtkBlueObeliskDataParser::EndElement ( const char *  name )

protected

void vtkBlueObeliskDataParser::CharacterDataHandler ( const char *  data, int  length  )

protected

void vtkBlueObeliskDataParser::SetCurrentValue ( const char *  data, int  length  )

protected

void vtkBlueObeliskDataParser::SetCurrentValue ( const char *  data )

protected

void vtkBlueObeliskDataParser::NewAtomStarted ( const char **  attr )

protected

void vtkBlueObeliskDataParser::NewAtomFinished ( )

protected

void vtkBlueObeliskDataParser::NewValueStarted ( const char **  attr )

protected

void vtkBlueObeliskDataParser::NewValueFinished ( )

protected

Member Data Documentation

vtkBlueObeliskData* vtkBlueObeliskDataParser::Target

protected

Definition at line 83 of file vtkBlueObeliskDataParser.h.

bool vtkBlueObeliskDataParser::IsProcessingAtom

protected

Definition at line 85 of file vtkBlueObeliskDataParser.h.

bool vtkBlueObeliskDataParser::IsProcessingValue

protected

Definition at line 89 of file vtkBlueObeliskDataParser.h.

std::string vtkBlueObeliskDataParser::CharacterDataValueBuffer

protected

Definition at line 93 of file vtkBlueObeliskDataParser.h.

enum vtkBlueObeliskDataParser::AtomValueType vtkBlueObeliskDataParser::CurrentValueType

protected

int vtkBlueObeliskDataParser::CurrentAtomicNumber

protected

Definition at line 117 of file vtkBlueObeliskDataParser.h.

vtkStdString* vtkBlueObeliskDataParser::CurrentSymbol

protected

Definition at line 118 of file vtkBlueObeliskDataParser.h.

vtkStdString* vtkBlueObeliskDataParser::CurrentName

protected

Definition at line 119 of file vtkBlueObeliskDataParser.h.

vtkStdString* vtkBlueObeliskDataParser::CurrentPeriodicTableBlock

protected

Definition at line 120 of file vtkBlueObeliskDataParser.h.

vtkStdString* vtkBlueObeliskDataParser::CurrentElectronicConfiguration

protected

Definition at line 121 of file vtkBlueObeliskDataParser.h.

vtkStdString* vtkBlueObeliskDataParser::CurrentFamily

protected

Definition at line 122 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentMass

protected

Definition at line 123 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentExactMass

protected

Definition at line 124 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentIonizationEnergy

protected

Definition at line 125 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentElectronAffinity

protected

Definition at line 126 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentPaulingElectronegativity

protected

Definition at line 127 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentCovalentRadius

protected

Definition at line 128 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentVDWRadius

protected

Definition at line 129 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentDefaultColor[3]

protected

Definition at line 130 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentBoilingPoint

protected

Definition at line 131 of file vtkBlueObeliskDataParser.h.

float vtkBlueObeliskDataParser::CurrentMeltingPoint

protected

Definition at line 132 of file vtkBlueObeliskDataParser.h.

unsigned int vtkBlueObeliskDataParser::CurrentPeriod

protected

Definition at line 133 of file vtkBlueObeliskDataParser.h.

unsigned int vtkBlueObeliskDataParser::CurrentGroup

protected

Definition at line 134 of file vtkBlueObeliskDataParser.h.

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The documentation for this class was generated from the following file:

• dox/Domains/Chemistry/vtkBlueObeliskDataParser.h