Package org.rcsb.cif.model.generated

Class PdbxNmrSystematicChemShiftOffset

java.lang.Object

org.rcsb.cif.model.BaseCategory

org.rcsb.cif.model.generated.PdbxNmrSystematicChemShiftOffset

All Implemented Interfaces:

Category

@Generated("org.rcsb.cif.generator.SchemaGenerator")
public class PdbxNmrSystematicChemShiftOffset
extends BaseCategory

Items in the pdbx_nmr_systematic_chem_shift_offset category define chemical shift offsets that systematically affect all chemical shifts in a set of assigned chemical shifts for a specific nuclei.

Field Summary

Fields inherited from class org.rcsb.cif.model.BaseCategory

isText, textFields

Constructor Summary

Constructors

Constructor	Description
PdbxNmrSystematicChemShiftOffset(String name)
PdbxNmrSystematicChemShiftOffset(String name, int rowCount, Object[] encodedColumns)
PdbxNmrSystematicChemShiftOffset(String name, Map<String,Column> columns)

Method Summary

Modifier and Type	Method	Description
IntColumn	getAssignedChemShiftListId()	Pointer to '_pdbx_nmr_assigned_chem_shift_list.id'
IntColumn	getAtomIsotopeNumber()	Mass number for the atom defined by the '.Atom_type' tag with a systematic chemical shift offset.
StrColumn	getAtomType()	The kind of atom to which the chemical shift offset value applies.
StrColumn	getEntryId()	Pointer to '_entry.id'
IntColumn	getOrdinal()	An ordinal identifier uniquely identifying records in the pdbx_nmr_systematic_chem_shift_offset category.
StrColumn	getType()	The kind of chemical shift offset that should be applied to all chemical shifts observed for a specific type of atom.
FloatColumn	getVal()	Chemical shift value that has been applied to all of the reported chemical shifts to bring their values in line with values expected to be observed for the chemical shift referencing that was used.
FloatColumn	getValErr()	Error in the reported chemical shift offset value used.

Methods inherited from class org.rcsb.cif.model.BaseCategory

getBinaryColumn, getCategoryName, getColumn, getColumnNames, getRowCount, isDefined

Methods inherited from class java.lang.Object

clone, equals, finalize, getClass, hashCode, notify, notifyAll, toString, wait, wait, wait

Methods inherited from interface org.rcsb.cif.model.Category

columnNames, columns, get

Constructor Detail

PdbxNmrSystematicChemShiftOffset

public PdbxNmrSystematicChemShiftOffset(String name,
                                        Map<String,Column> columns)

PdbxNmrSystematicChemShiftOffset

public PdbxNmrSystematicChemShiftOffset(String name,
                                        int rowCount,
                                        Object[] encodedColumns)

PdbxNmrSystematicChemShiftOffset

public PdbxNmrSystematicChemShiftOffset(String name)

Method Detail

getType

public StrColumn getType()

The kind of chemical shift offset that should be applied to all chemical shifts observed for a specific type of atom.

Returns:

StrColumn

getAtomType

public StrColumn getAtomType()

The kind of atom to which the chemical shift offset value applies.

Returns:

StrColumn

getAtomIsotopeNumber

public IntColumn getAtomIsotopeNumber()

Mass number for the atom defined by the '.Atom_type' tag with a systematic chemical shift offset.

Returns:

IntColumn

getVal

public FloatColumn getVal()

Chemical shift value that has been applied to all of the reported chemical shifts to bring their values in line with values expected to be observed for the chemical shift referencing that was used.

Returns:

FloatColumn

getValErr

public FloatColumn getValErr()

Error in the reported chemical shift offset value used.

Returns:

FloatColumn

getEntryId

public StrColumn getEntryId()

Pointer to '_entry.id'

Returns:

StrColumn

getAssignedChemShiftListId

public IntColumn getAssignedChemShiftListId()

Pointer to '_pdbx_nmr_assigned_chem_shift_list.id'

Returns:

IntColumn

getOrdinal

public IntColumn getOrdinal()

An ordinal identifier uniquely identifying records in the pdbx_nmr_systematic_chem_shift_offset category.

Returns:

IntColumn