gpp4
1.3.1
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Definition of MTZ data structure. More...
Go to the source code of this file.
Classes | |
struct | MTZCOL |
struct | MTZSET |
struct | MTZXTAL |
struct | bathead |
struct | SYMGRP |
union | MNF |
struct | MTZ |
Macros | |
#define | MTZVERSN "MTZ:V1.1" |
#define | MTZ_MAJOR_VERSN 1 |
#define | MTZ_MINOR_VERSN 1 |
#define | CCP4_MTZDATA 20100630 |
#define | SIZE1 20 |
#define | MTZRECORDLENGTH 80 |
#define | MAXSPGNAMELENGTH 20 |
#define | NBATCHWORDS 185 |
#define | NBATCHINTEGERS 29 |
#define | NBATCHREALS 156 |
#define | MXTALS 100 |
#define | MSETS 1000 |
#define | MCOLUMNS 10000 |
Typedefs | |
typedef struct bathead | MTZBAT |
Definition of MTZ data structure.
The file defines a hierarchy of structs which hold the MTZ data structure.
#define CCP4_MTZDATA 20100630 |
Date stamp for the cmtz data structure (update if there are changes to the structs in this file)
#define MAXSPGNAMELENGTH 20 |
max length of a spacegroup name
Referenced by ccp4_lwsymm_c(), and MtzPut().
#define MCOLUMNS 10000 |
maximum number of columns (for a few arrays - to be removed!)
Referenced by ccp4_lwrefl(), FORTRAN_SUBR(), MtzAddColumn(), MtzGetUserCellTolerance(), and MtzPut().
#define MSETS 1000 |
maximum number of datasets (for a few arrays - to be removed!)
Referenced by MtzGetUserCellTolerance().
#define MTZ_MAJOR_VERSN 1 |
MTZ file major version - keep to single digit
Referenced by FORTRAN_SUBR(), MtzGetUserCellTolerance(), and MtzPut().
#define MTZ_MINOR_VERSN 1 |
MTZ file minor version - keep to single digit
Referenced by FORTRAN_SUBR(), MtzGetUserCellTolerance(), and MtzPut().
#define MTZRECORDLENGTH 80 |
length of records
Referenced by ccp4_lhprt(), ccp4_lhprt_adv(), MtzAddHistory(), MtzCallocHist(), MtzGetUserCellTolerance(), MtzPut(), and MtzWhdrLine().
#define MTZVERSN "MTZ:V1.1" |
traditional version number!
#define MXTALS 100 |
maximum number of crystals (for a few arrays - to be removed!)
Referenced by MtzGetUserCellTolerance().
#define NBATCHINTEGERS 29 |
size of integer section of batch header buffer
Referenced by ccp4_lrbat(), ccp4_lwbat(), FORTRAN_SUBR(), MtzBatchToArray(), MtzGetUserCellTolerance(), and MtzPut().
#define NBATCHREALS 156 |
size of float section of batch header buffer
Referenced by ccp4_lrbat(), FORTRAN_SUBR(), MtzBatchToArray(), and MtzPut().
#define NBATCHWORDS 185 |
total size of batch header buffer
Referenced by ccp4_lrbat(), FORTRAN_SUBR(), MtzGetUserCellTolerance(), and MtzPut().
#define SIZE1 20 |
defines for sizes in MTZ structure size of pre-reflection block
Referenced by MtzGetUserCellTolerance(), MtzOpenForWrite(), MtzPut(), and MtzRewdInput().