internal struct for storing PDB residue related information More...

#include <PDBInfo.hh>

Public Member Functions
	ResidueRecord ()
	default constructor More...

Public Attributes
char	chainID
	chain letter More...

int	resSeq
	residue sequence number More...

char	iCode
	insertion code More...

std::string	segmentID
	segment ID More...

AtomRecords	atomRec
	vector of AtomRecord More...

utility::vector1< std::string >	label
	Added in 2013 by dadriano. A vector of labels in the AtomRecord that can be used to store residue-based information that you want/can-use to communicate movers with moverts or afthermath for task-opperations. More...

Detailed Description

internal struct for storing PDB residue related information

Constructor & Destructor Documentation

◆ ResidueRecord()

core::pose::PDBInfo::ResidueRecord::ResidueRecord ( )

inline

default constructor

Member Data Documentation

◆ atomRec

AtomRecords core::pose::PDBInfo::ResidueRecord::atomRec

vector of AtomRecord

sized the same as number of atoms for a given instance of core::conformation::Residue

Referenced by core::pose::PDBInfo::append_res(), and core::pose::PDBInfo::prepend_res().

◆ chainID

char core::pose::PDBInfo::ResidueRecord::chainID

chain letter

Referenced by core::pose::PDBInfo::chain(), core::pose::PDBInfo::delete_res(), core::pose::PDBInfo::icode(), core::pose::PDBInfo::number(), core::pose::PDBInfo::PDBInfo(), and core::pose::PDBInfo::set_resinfo().

◆ iCode

char core::pose::PDBInfo::ResidueRecord::iCode

insertion code

Referenced by core::pose::PDBInfo::chain(), core::pose::PDBInfo::delete_res(), core::pose::PDBInfo::icode(), core::pose::PDBInfo::number(), and core::pose::PDBInfo::set_resinfo().

◆ label

utility::vector1< std::string > core::pose::PDBInfo::ResidueRecord::label

Added in 2013 by dadriano. A vector of labels in the AtomRecord that can be used to store residue-based information that you want/can-use to communicate movers with moverts or afthermath for task-opperations.

Referenced by core::pose::PDBInfo::add_reslabel(), core::pose::PDBInfo::clear_reslabel(), and core::pose::PDBInfo::set_resinfo().

◆ resSeq

int core::pose::PDBInfo::ResidueRecord::resSeq

residue sequence number

Referenced by core::pose::PDBInfo::chain(), core::pose::PDBInfo::delete_res(), core::pose::PDBInfo::icode(), core::pose::PDBInfo::number(), core::pose::PDBInfo::PDBInfo(), and core::pose::PDBInfo::set_resinfo().

◆ segmentID

std::string core::pose::PDBInfo::ResidueRecord::segmentID

segment ID

Referenced by core::pose::PDBInfo::chain(), core::pose::PDBInfo::delete_res(), core::pose::PDBInfo::icode(), core::pose::PDBInfo::number(), core::pose::PDBInfo::segmentID(), and core::pose::PDBInfo::set_resinfo().

The documentation for this struct was generated from the following file:

src/core/pose/PDBInfo.hh

Public Member Functions

Public Attributes