BALL 1.5.0
Public Member Functions | Public Attributes | List of all members
BALL::NMRStarFile::MolecularSystem::ChemicalUnit Class Reference

#include <BALL/FORMAT/NMRStarFile.h>

Public Member Functions

 ChemicalUnit ()
 
std::ostream & operator>> (std::ostream &s)
 
void clear ()
 

Public Attributes

String component_name
 
String label
 
MonomericPolymermonomeric_polymer
 
NMRAtomDataSetshifts
 

Detailed Description

Definition at line 382 of file NMRStarFile.h.

Constructor & Destructor Documentation

◆ ChemicalUnit()

BALL::NMRStarFile::MolecularSystem::ChemicalUnit::ChemicalUnit ( )

Member Function Documentation

◆ clear()

void BALL::NMRStarFile::MolecularSystem::ChemicalUnit::clear ( )

◆ operator>>()

std::ostream & BALL::NMRStarFile::MolecularSystem::ChemicalUnit::operator>> ( std::ostream &  s)

Member Data Documentation

◆ component_name

String BALL::NMRStarFile::MolecularSystem::ChemicalUnit::component_name

Definition at line 389 of file NMRStarFile.h.

◆ label

String BALL::NMRStarFile::MolecularSystem::ChemicalUnit::label

Definition at line 390 of file NMRStarFile.h.

◆ monomeric_polymer

MonomericPolymer* BALL::NMRStarFile::MolecularSystem::ChemicalUnit::monomeric_polymer

Definition at line 391 of file NMRStarFile.h.

◆ shifts

NMRAtomDataSet* BALL::NMRStarFile::MolecularSystem::ChemicalUnit::shifts

Definition at line 392 of file NMRStarFile.h.