RDKit::RealValueVect Class Reference

#include <RealValueVect.h>

Public Member Functions
	RealValueVect ()=default
	RealValueVect (unsigned int length)
	initialize with a particular size
	RealValueVect (unsigned int length, double val)
	initialize with a particular size and initial value
	RealValueVect (const std::string &pkl)
	constructor from a pickle
	RealValueVect (const char *pkl, unsigned int len)
	constructor from a pickle
double	getVal (unsigned int i) const
	return the value at an index
double	operator[] (unsigned int idx) const
	support indexing using []
void	setVal (unsigned int i, double val)
	set the value at an index
double	getTotalVal () const
	returns the sum of all the elements in the vect
unsigned int	getLength () const
	returns the length
unsigned int	size () const
	returns the length
bool	compareVectors (const RealValueVect &other) const
	compares 2 vectors and returns false if different
RealValueVect &	operator&= (const RealValueVect &other)
	in-place operator&
RealValueVect &	operator|= (const RealValueVect &other)
	in-place operator|
RealValueVect &	operator+= (const RealValueVect &other)
	in-place operator+
RealValueVect &	operator-= (const RealValueVect &other)
	in-place operator-
std::string	toString () const
	returns a binary string representation (pickle)
void	setLength (unsigned int sz)
void	setToVal (double val)
const std::vector< double > &	getData () const
std::vector< double > &	getData ()

Detailed Description

a class for efficiently storing vectors of double values Has additional features compared to std::vector<double>: construct from and write to pickle

Definition at line 27 of file RealValueVect.h.

Constructor & Destructor Documentation

RealValueVect() [1/5]

RDKit::RealValueVect::RealValueVect ( )

default

RealValueVect() [2/5]

RDKit::RealValueVect::RealValueVect ( unsigned int  length )

inline

initialize with a particular size

Definition at line 31 of file RealValueVect.h.

RealValueVect() [3/5]

RDKit::RealValueVect::RealValueVect ( unsigned int  length, double  val  )

inline

initialize with a particular size and initial value

Definition at line 36 of file RealValueVect.h.

RealValueVect() [4/5]

RDKit::RealValueVect::RealValueVect ( const std::string &  pkl )

inline

constructor from a pickle

Definition at line 41 of file RealValueVect.h.

RealValueVect() [5/5]

RDKit::RealValueVect::RealValueVect ( const char *  pkl, unsigned int  len  )

inline

constructor from a pickle

Definition at line 46 of file RealValueVect.h.

Member Function Documentation

compareVectors()

bool RDKit::RealValueVect::compareVectors

(

const RealValueVect &

other

)

const

compares 2 vectors and returns false if different

getData() [1/2]

std::vector< double > & RDKit::RealValueVect::getData ( )

inline

Definition at line 91 of file RealValueVect.h.

getData() [2/2]

const std::vector< double > & RDKit::RealValueVect::getData ( ) const

inline

Definition at line 90 of file RealValueVect.h.

getLength()

unsigned int RDKit::RealValueVect::getLength ( ) const

inline

returns the length

Definition at line 61 of file RealValueVect.h.

getTotalVal()

double RDKit::RealValueVect::getTotalVal

(

)

const

returns the sum of all the elements in the vect

getVal()

double RDKit::RealValueVect::getVal

(

unsigned int

i

)

const

return the value at an index

operator&=()

RealValueVect & RDKit::RealValueVect::operator&=

(

const RealValueVect &

other

)

in-place operator&

operator+=()

RealValueVect & RDKit::RealValueVect::operator+=

(

const RealValueVect &

other

)

in-place operator+

operator-=()

RealValueVect & RDKit::RealValueVect::operator-=

(

const RealValueVect &

other

)

in-place operator-

operator[]()

double RDKit::RealValueVect::operator[] ( unsigned int  idx ) const

inline

support indexing using []

Definition at line 52 of file RealValueVect.h.

operator|=()

RealValueVect & RDKit::RealValueVect::operator|=

(

const RealValueVect &

other

)

in-place operator|

setLength()

void RDKit::RealValueVect::setLength ( unsigned int  sz )

inline

Definition at line 84 of file RealValueVect.h.

setToVal()

void RDKit::RealValueVect::setToVal ( double  val )

inline

Definition at line 88 of file RealValueVect.h.

setVal()

void RDKit::RealValueVect::setVal	(	unsigned int	i,
		double	val
	)

set the value at an index

size()

unsigned int RDKit::RealValueVect::size ( ) const

inline

returns the length

Definition at line 64 of file RealValueVect.h.

toString()

std::string RDKit::RealValueVect::toString

(

)

const

returns a binary string representation (pickle)

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

• RealValueVect.h