core::pose::PDBInfo::ResidueRecord Struct Reference

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

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

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

inline

default constructor

Member Data Documentation

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().

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().

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().

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().

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().

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().

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

• src/core/pose/PDBInfo.hh