PDBHetatm Class Reference

#include <PDBData.h>

Inheritance diagram for PDBHetatm:

Public Member Functions
	PDBHetatm (const char *data)
virtual	~PDBHetatm (void)
Public Member Functions inherited from PDBAtom
	PDBAtom (void)
virtual	~PDBAtom (void)
void	parse (const char *s)
void	sprint (char *s, PDBFormatStyle usestyle=COLUMNS)
int	serialnumber (void)
void	serialnumber (int newserialnumber)
const char *	name (void)
void	name (const char *newname)
const char *	alternatelocation (void)
void	alternatelocation (const char *newalternatelocation)
const char *	residuename (void)
void	residuename (const char *newresiduename)
const char *	chain (void)
void	chain (const char *newchain)
int	residueseq (void)
void	residueseq (int newresidueseq)
const char *	insertioncode (void)
void	insertioncode (const char *newinsertioncode)
BigReal	xcoor (void)
void	xcoor (BigReal newxcoor)
BigReal	ycoor (void)
void	ycoor (BigReal newycoor)
BigReal	zcoor (void)
void	zcoor (BigReal newzcoor)
const BigReal *	coordinates (void)
void	coordinates (const BigReal *newcoordinates)
BigReal	occupancy (void)
void	occupancy (BigReal newoccupancy)
BigReal	temperaturefactor (void)
void	temperaturefactor (BigReal newtemperaturefactor)
int	footnote (void)
void	footnote (int newfootnote)
const char *	segmentname (void)
void	segmentname (const char *newsegmentname)
const char *	element (void)
void	element (const char *newelement)
Public Member Functions inherited from PDBData
	PDBData (PDBType newtype)
virtual	~PDBData (void)
PDBType	type (void)

Additional Inherited Members
Public Types inherited from PDBAtom
enum	Start {   STYPE =1, SSERIAL =7, SNAME =13, SALT =17,   SRESNAME =18, SCHAIN =22, SRESSEQ =23, SINSERT =27,   SX =31, SY =39, SZ =47, SOCC =55,   STEMPF =61, SFOOT =68, SSEGNAME =73, SELEMENT =77 }
enum	Length {   LTYPE =6, LSERIAL =5, LNAME =4, LALT =1,   LRESNAME =4, LCHAIN =1, LRESSEQ =4, LINSERT =1,   LCOOR =8, LCOORPREC =3, LOCC =6, LOCCPREC =2,   LTEMPF =6, LTEMPFPREC =2, LFOOT =3, LSEGNAME =4,   LELEMENT =2 }
Public Types inherited from PDBData
enum	PDBType {   HEADER, OBSLTE, COMPND, SOURCE,   EXPDTA, AUTHOR, REVDAT, SPRSDE,   JRNL, REMARK, SEQRES, FTNOTE,   HET, FORMUL, HELIX, SHEET,   TURN, SSBOND, SITE, CRYST1,   ORIGX, SCALE, MTRIX, TVECT,   MODEL, ATOM, HETATM, SIGATM,   ANISOU, SIGUIJ, TER, ENDMDL,   CONECT, MASTER, END, UNKNOWN }
enum	PDBFormatStyle { COLUMNS, FIELDS }
Static Public Attributes inherited from PDBAtom
static const int	default_serial = -1
static const int	default_residueseq = -1
static const BigReal	default_coor = 9999.000
static const BigReal	default_occupancy = 1.00
static const BigReal	default_temperaturefactor = 0.00
static const int	no_footnote = 0
Static Public Attributes inherited from PDBData
static const char *	PDBNames [UNKNOWN+1]
Protected Types inherited from PDBAtom
enum	PDBPossibleAtoms { USE_ATOM = ATOM, USE_HETATM = HETATM }
Protected Member Functions inherited from PDBAtom
	PDBAtom (const char *data, PDBPossibleAtoms whichatom)
Static Protected Member Functions inherited from PDBData
static void	scan (const char *data, int len, int start, int size, int *ans, int defalt)
static void	scan (const char *data, int len, int start, int size, BigReal *ans, BigReal defalt)
static void	scan (const char *data, int len, int start, int size, char *ans)
static void	field (const char *data, int fld, char *result)
static void	sprintcol (char *s, int start, int len, const char *val)
static void	sprintcol (char *s, int start, int len, int val)
	*** provide a simple way to print to a specific column More...
static void	sprintcol (char *s, int start, int len, int prec, BigReal val)

Detailed Description

Definition at line 250 of file PDBData.h.

Constructor & Destructor Documentation

PDBHetatm::PDBHetatm ( const char *  data )

inline

Definition at line 252 of file PDBData.h.

                                 :
         PDBAtom( data, PDBAtom::USE_HETATM) {
    }

virtual PDBHetatm::~PDBHetatm ( void  )

inlinevirtual

Definition at line 255 of file PDBData.h.

                              {
    }

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

• PDBData.h