BALL::NMRStarFile::NMRAtomData Class Reference

#include <BALL/FORMAT/NMRStarFile.h>

Public Member Functions
	NMRAtomData ()
bool	operator== (const NMRAtomData &atom) const
std::ostream &	operator>> (std::ostream &s)

Public Attributes
Position	atom_ID
Position	residue_seq_code
String	residue_label
String	atom_name
char	atom_type
float	shift_value
float	error_value
Position	ambiguity_code

Detailed Description

NMRAtomData This class includes all information for one atom delivered by a NMRStar file. All members are public for easy access.

Definition at line 239 of file NMRStarFile.h.

Constructor & Destructor Documentation

BALL::NMRStarFile::NMRAtomData::NMRAtomData

(

)

Member Function Documentation

bool BALL::NMRStarFile::NMRAtomData::operator==

(

const NMRAtomData &

atom

)

const

std::ostream& BALL::NMRStarFile::NMRAtomData::operator>>

(

std::ostream &

s

)

Member Data Documentation

Position BALL::NMRStarFile::NMRAtomData::ambiguity_code

Definition at line 251 of file NMRStarFile.h.

Position BALL::NMRStarFile::NMRAtomData::atom_ID

Definition at line 244 of file NMRStarFile.h.

String BALL::NMRStarFile::NMRAtomData::atom_name

Definition at line 247 of file NMRStarFile.h.

char BALL::NMRStarFile::NMRAtomData::atom_type

Definition at line 248 of file NMRStarFile.h.

float BALL::NMRStarFile::NMRAtomData::error_value

Definition at line 250 of file NMRStarFile.h.

String BALL::NMRStarFile::NMRAtomData::residue_label

Definition at line 246 of file NMRStarFile.h.

Position BALL::NMRStarFile::NMRAtomData::residue_seq_code

Definition at line 245 of file NMRStarFile.h.

float BALL::NMRStarFile::NMRAtomData::shift_value

Definition at line 249 of file NMRStarFile.h.