Isotrop_Energy_Well_Physical_System::Conformation Class Reference

#include <isotrop_energy_well_physical_system.hpp>

Public Types
typedef std::vector< double >	Data_Type
typedef double	Float_Type

Public Member Functions
double	get_energy () const
std::vector< double > &	get_data ()
const std::vector< double > &	get_data () const
std::vector< double > &	get_grad ()
const std::vector< double > &	get_grad () const
double *	get_grad_as_C_array ()

Public Attributes
std::vector< double >	data
std::vector< double >	grad
double	energy

Member Typedef Documentation

Data_Type

typedef std::vector<double> Data_Type

Float_Type

typedef double Float_Type

Member Function Documentation

get_data() [1/2]

std::vector<double>& get_data ( )

inline

get_data() [2/2]

const std::vector<double>& get_data ( ) const

inline

get_energy()

double get_energy ( ) const

inline

get_grad() [1/2]

std::vector<double>& get_grad ( )

inline

get_grad() [2/2]

const std::vector<double>& get_grad ( ) const

inline

get_grad_as_C_array()

double* get_grad_as_C_array ( )

inline

Member Data Documentation

data

std::vector<double> data

energy

double energy

grad

std::vector<double> grad