read_npt.c File Reference

Functions to read NPT data. More...

#include "global.h"
#include "bind.h"
#include "interface.h"
#include "project.h"
#include <ctype.h>
#include "cbuild_edit.h"

Include dependency graph for read_npt.c:

Go to the source code of this file.

Data Structures
struct	cell_file

Typedefs
typedef struct cell_file	cell_file

Functions
void	add_cell_info (gchar *info)
	append information message to the cell information
int	cell_get_lattice (int format)
	get the lattice parameters format from the file
int	open_cell_file (int format, gchar *filename)
	open the file that contains the cell parameters

Variables
FILE *	cellp
cell_file *	this_cell

Detailed Description

Functions to read NPT data.

Author

Sébastien Le Roux sebas.nosp@m.tien.nosp@m..lero.nosp@m.ux@i.nosp@m.pcms..nosp@m.unis.nosp@m.tra.f.nosp@m.r

Definition in file read_npt.c.

Typedef Documentation

cell_file

typedef struct cell_file cell_file

Definition at line 54 of file read_npt.c.

Function Documentation

add_cell_info()

void add_cell_info

(

gchar *

info

)

append information message to the cell information

Parameters

info	the cell information message

Definition at line 70 of file read_npt.c.

cell_get_lattice()

int cell_get_lattice

(

int

format

)

get the lattice parameters format from the file

Parameters

format

File format

Definition at line 82 of file read_npt.c.

open_cell_file()

int open_cell_file	(	int	format,
		gchar *	filename )

open the file that contains the cell parameters

Parameters

format	File format
filename	File name

Definition at line 232 of file read_npt.c.

Variable Documentation

cellp

FILE* cellp

Definition at line 52 of file read_npt.c.

this_cell

cell_file* this_cell

Definition at line 61 of file read_npt.c.