#include <pdb.h>

Public Attributes
std::string	record
	Record Type ("ATOM " or "HETATM") More...

int	serial
	atom serial number More...

double	x
	Position X. More...

double	y
	Position Y. More...

double	z
	Position Z. More...

std::string	name
	Name. More...

std::string	altloc
	Alternate location. More...

std::string	resname
	Residue name. More...

char	chainid
	ChainId. More...

int	resseq
	Residue sequence. More...

std::string	icode
	Icode. More...

double	occupancy
	Occupancy. More...

double	bfactor
	Bfactor. More...

std::string	atomType
	atom element type More...

std::string	charge
	2-char charge with sign 2nd (e.g. 1- or 2+) More...

std::string	segment
	segment name More...

std::string	altId

int	seqId

int	authSeqId

std::string	authCompId

std::string	authAsymId

std::string	authAtomId

int	pdbNum

Detailed Description

Atom class.

Definition at line 174 of file pdb.h.

Member Data Documentation

◆ altId

std::string RichAtom::altId

Definition at line 228 of file pdb.h.

◆ altloc

std::string RichAtom::altloc

Alternate location.

Definition at line 196 of file pdb.h.

◆ atomType

std::string RichAtom::atomType

atom element type

Definition at line 217 of file pdb.h.

◆ authAsymId

std::string RichAtom::authAsymId

Definition at line 240 of file pdb.h.

◆ authAtomId

std::string RichAtom::authAtomId

Definition at line 243 of file pdb.h.

◆ authCompId

std::string RichAtom::authCompId

Definition at line 237 of file pdb.h.

◆ authSeqId

int RichAtom::authSeqId

Definition at line 234 of file pdb.h.

◆ bfactor

double RichAtom::bfactor

Bfactor.

Definition at line 214 of file pdb.h.

◆ chainid

char RichAtom::chainid

ChainId.

Definition at line 202 of file pdb.h.

◆ charge

std::string RichAtom::charge

2-char charge with sign 2nd (e.g. 1- or 2+)

Definition at line 220 of file pdb.h.

◆ icode

std::string RichAtom::icode

Icode.

Definition at line 208 of file pdb.h.

◆ name

std::string RichAtom::name

Name.

Definition at line 193 of file pdb.h.

◆ occupancy

double RichAtom::occupancy

Occupancy.

Definition at line 211 of file pdb.h.

◆ pdbNum

int RichAtom::pdbNum

Definition at line 246 of file pdb.h.

◆ record

std::string RichAtom::record

Record Type ("ATOM " or "HETATM")

Definition at line 178 of file pdb.h.

◆ resname

std::string RichAtom::resname

Residue name.

Definition at line 199 of file pdb.h.

◆ resseq

int RichAtom::resseq

Residue sequence.

Definition at line 205 of file pdb.h.

◆ segment

std::string RichAtom::segment

segment name

Definition at line 224 of file pdb.h.

◆ seqId

int RichAtom::seqId

Definition at line 231 of file pdb.h.

◆ serial

int RichAtom::serial

atom serial number

Definition at line 181 of file pdb.h.

◆ x

double RichAtom::x

Position X.

Definition at line 184 of file pdb.h.

◆ y

double RichAtom::y

Position Y.

Definition at line 187 of file pdb.h.

◆ z

double RichAtom::z

Position Z.

Definition at line 190 of file pdb.h.

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

xmipp/libraries/data/pdb.h

Public Attributes