utils.h File Reference

#include "types.h"
#include <RDGeneral/Invariant.h>
#include <RDGeneral/BoostStartInclude.h>
#include <boost/random.hpp>
#include <RDGeneral/BoostEndInclude.h>

Go to the source code of this file.

Namespaces
	RDKit
	Includes a bunch of functionality for handling Atom and Bond queries.

Typedefs
typedef boost::minstd_rand	RDKit::rng_type
typedef boost::uniform_int	RDKit::uniform_int
typedef boost::uniform_real	RDKit::uniform_double
typedef boost::variate_generator< rng_type &, uniform_int >	RDKit::int_source_type
typedef boost::variate_generator< rng_type &, uniform_double >	RDKit::double_source_type

Functions
double	RDKit::computeIntVectPrimesProduct (const INT_VECT &ring)
	compute the product of the set of primes corresponding to the values in an INT_VECT More...
bool	RDKit::feq (double v1, double v2, double tol=1e-4)
	floating point comparison with a tolerance More...
rng_type &	RDKit::getRandomGenerator (int seed=-1)
	Optionally seed and return a reference to the global (Boost) random. More...
double	RDKit::getRandomVal (int seed=-1)
double_source_type &	RDKit::getDoubleRandomSource ()
	return a reference to the global (Boost) random source More...
template<class T >
unsigned int	RDKit::countSwapsToInterconvert (const T &ref, T probe)
template<unsigned n>
double	int_pow (double x)
template<>
double	int_pow< 0 > (double)
template<>
double	int_pow< 1 > (double x)

Variables
const int	RDKit::FILE_MAXLINE
	an assumed maximum length for lines read from files More...

Function Documentation

int_pow()

template<unsigned n>

double int_pow ( double  x )

inline

Definition at line 84 of file utils.h.

int_pow< 0 >()

template<>

double int_pow< 0 > ( double  )

inline

Definition at line 93 of file utils.h.

int_pow< 1 >()

template<>

double int_pow< 1 > ( double  x )

inline

Definition at line 98 of file utils.h.