gpp4  1.3.1
Public Attributes | List of all members
MTZ Struct Reference

#include <mtzdata.h>

Public Attributes

CCP4Filefilein
 
CCP4Filefileout
 
char title [71]
 
char * hist
 
int histlines
 
int nxtal
 
int ncol_read
 
int nref
 
int nref_filein
 
int refs_in_memory
 
int n_orig_bat
 
float resmax_out
 
float resmin_out
 
MNF mnf
 
SYMGRP mtzsymm
 
MTZXTAL ** xtal
 
MTZBATbatch
 
MTZCOLorder [5]
 
char * xml
 
char * unknown_headers
 
int n_unknown_headers
 

Detailed Description

Top level of MTZ struct.

Member Data Documentation

◆ batch

MTZBAT* MTZ::batch

first batch header

Referenced by ccp4_lrbats(), ccp4_lwbat(), MtzFree(), MtzNbat(), and MtzNbatchesInSet().

◆ filein

CCP4File* MTZ::filein

file for reading

Referenced by MtzDebugHierarchy(), MtzFree(), and MtzRewdInput().

◆ fileout

CCP4File* MTZ::fileout

file for writing

Referenced by MtzDebugHierarchy(), and MtzFree().

◆ hist

char* MTZ::hist

history of mtz file

Referenced by ccp4_lhprt(), ccp4_lrhist(), MtzAddHistory(), and MtzFree().

◆ histlines

int MTZ::histlines

number of lines in hist

Referenced by ccp4_lhprt(), ccp4_lrhist(), and MtzAddHistory().

◆ mnf

MNF MTZ::mnf

value of missing number flag

Referenced by ccp4_ismnf(), and ccp4_lhprt().

◆ mtzsymm

SYMGRP MTZ::mtzsymm

◆ n_orig_bat

int MTZ::n_orig_bat

original number of batches

Referenced by ccp4_lhprt(), ccp4_lrbats(), ccp4_lwbat(), and MtzNbatchesInSet().

◆ n_unknown_headers

int MTZ::n_unknown_headers

unknown header data

◆ ncol_read

int MTZ::ncol_read

number of columns from file

◆ nref

int MTZ::nref

total number of reflections

Referenced by ccp4_lhprt(), MtzAddColumn(), MtzDeleteRefl(), and MtzNref().

◆ nref_filein

int MTZ::nref_filein

number of reflections from input file

◆ nxtal

int MTZ::nxtal

◆ order

MTZCOL* MTZ::order[5]

sort order

Referenced by ccp4_lrsort(), and MtzSetSortOrder().

◆ refs_in_memory

int MTZ::refs_in_memory

whether reflections are held in memory

Referenced by MtzAddColumn(), and MtzDeleteRefl().

◆ resmax_out

float MTZ::resmax_out

output file max res

Referenced by ccp4_lhprt().

◆ resmin_out

float MTZ::resmin_out

output file min res

Referenced by ccp4_lhprt().

◆ title

char MTZ::title[71]

title of mtz structure

Referenced by ccp4_lhprt(), ccp4_lrtitl(), and ccp4_lwtitl().

◆ unknown_headers

char* MTZ::unknown_headers

unknown header data

Referenced by MtzFree().

◆ xml

char* MTZ::xml

xml data block

Referenced by MtzFree().

◆ xtal

MTZXTAL** MTZ::xtal

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