BALL::ShiftReferenceElement Struct Reference

ShiftReferenceElement. More...

#include <NMRStarFile.h>

List of all members.

Public Attributes
String	mol_common_name
char	atom_type
Position	isotope_number
String	atom_group
String	shift_units
float	shift_value
char	reference_method
char	reference_type
float	indirect_shift_ratio

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Detailed Description

ShiftReferenceElement.

This structure includes all information for a shift reference element for one atom type delivered by a NMR-Star-File. All members are public for easy access.