BALL 1.5.0
Loading...
Searching...
No Matches
BALL::NumberOfHydrogen Class Reference

#include <BALL/QSAR/simpleDescriptors.h>

Inheritance diagram for BALL::NumberOfHydrogen:
BALL::SimpleBase BALL::Descriptor BALL::UnaryProcessor< AtomContainer > BALL::UnaryFunctor< AtomContainer, Processor::Result >

Public Member Functions

Constructors and Destructors
 NumberOfHydrogen ()
 
 NumberOfHydrogen (const NumberOfHydrogen &nh)
 
virtual ~NumberOfHydrogen ()
 
Assignment
NumberOfHydrogenoperator= (const NumberOfHydrogen &nh)
 
- Public Member Functions inherited from BALL::SimpleBase
 SimpleBase ()
 
 SimpleBase (const SimpleBase &sb)
 
 SimpleBase (const String &name)
 
 SimpleBase (const String &name, const String &unit)
 
virtual ~SimpleBase ()
 
virtual SimpleBaseoperator= (const SimpleBase &sb)
 
void computeAllDescriptors (AtomContainer &ac)
 
void setDataFolder (const char *folder)
 
- Public Member Functions inherited from BALL::Descriptor
 Descriptor ()
 
 Descriptor (const Descriptor &descriptor)
 
 Descriptor (const String &name)
 
 Descriptor (const String &name, const String &unit)
 
virtual ~Descriptor ()
 
Descriptoroperator= (const Descriptor &descriptor)
 
Processor::Result operator() (AtomContainer &ac)
 
const StringgetName () const
 
void setName (const String &name)
 
void setUnit (const String &name)
 
const StringgetUnit () const
 
virtual double compute (AtomContainer &ac)
 
- Public Member Functions inherited from BALL::UnaryProcessor< AtomContainer >
 UnaryProcessor ()
 
 UnaryProcessor (const UnaryProcessor &)
 
virtual ~UnaryProcessor ()
 
virtual bool start ()
 
virtual bool finish ()
 

Additional Inherited Members

- Public Types inherited from BALL::UnaryFunctor< AtomContainer, Processor::Result >
typedef Processor::Result result_type
 
typedef AtomContainer argument_type
 
typedef AtomContainerargument_reference
 
typedef const AtomContainerconst_argument_reference
 
typedef AtomContainerargument_pointer
 
typedef const AtomContainerconst_argument_pointer
 
- Protected Member Functions inherited from BALL::SimpleBase
bool isValid_ (AtomContainer &ac)
 
void calculate_ (AtomContainer &ac)
 
- Protected Member Functions inherited from BALL::Descriptor

Detailed Description

This descriptor counts the number of hydrogen

Definition at line 599 of file simpleDescriptors.h.

Constructor & Destructor Documentation

◆ NumberOfHydrogen() [1/2]

BALL::NumberOfHydrogen::NumberOfHydrogen ( )

Default constructor

◆ NumberOfHydrogen() [2/2]

BALL::NumberOfHydrogen::NumberOfHydrogen ( const NumberOfHydrogen & nh)

Copy constructor

◆ ~NumberOfHydrogen()

virtual BALL::NumberOfHydrogen::~NumberOfHydrogen ( )
virtual

Destructor

Member Function Documentation

◆ operator=()

NumberOfHydrogen & BALL::NumberOfHydrogen::operator= ( const NumberOfHydrogen & nh)

Assignment operator