arcanis/moldyn
1
0
Fork 0
mirror of https://github.com/arcan1s/moldyn.git synced 2025-07-23 02:29:58 +00:00
Code Issues Projects Releases Wiki Activity

edited documentation

Browse Source
This commit is contained in:
arcan1s
2014-01-29 02:42:45 +04:00
parent b8e195de85
commit 34a2c5c090
82 changed files with 602 additions and 306 deletions
Download Patch File Download Diff File Expand all files Collapse all files

15
mathmech/mm/include/mathmech/read_puma.h
View File

@ -7,19 +7,17 @@
* ----------------------------------------------------------------------------
*/
/**
* @file
* @file read_puma.h
* Header of mathmech library
* @author Evgeniy Alekseev (arcanis)
* @copyright Beerware
* @bug No known bugs
*/
#ifndef READ_PUMA_H
#define READ_PUMA_H
/**
* @fn rw_puma
*/
int rw_puma (const char *input, const int step, const char *output, const int num_types,
const int *num_mol, const int *num_atoms, const char *ch_atom_types,
const int *atom_types, float *coords);
/**
* @brief function that read PUMA trajectory file and write to output
* @code
@ -40,6 +38,9 @@ int rw_puma (const char *input, const int step, const char *output, const int nu
* @return 1 - file does not exist
* @return 0 - exit without errors
*/
int rw_puma (const char *input, const int step, const char *output, const int num_types,
const int *num_mol, const int *num_atoms, const char *ch_atom_types,
const int *atom_types, float *coords);
#endif /* READ_PUMA_H */