diff options
Diffstat (limited to 'include')
| -rw-r--r-- | include/tng_io.h | 35 |
1 files changed, 32 insertions, 3 deletions
diff --git a/include/tng_io.h b/include/tng_io.h index f6eb637..fb4efd6 100644 --- a/include/tng_io.h +++ b/include/tng_io.h @@ -1072,7 +1072,7 @@ tng_function_status DECLSPECDLLEXPORT tng_input_file_len_get /** * @brief Get the number of frames in the trajectory - * @param tng_data the trajectory of which to get the number of frames. + * @param tng_data is the trajectory of which to get the number of frames. * @param n is pointing to a value set to the number of frames. * @pre \code tng_data != 0 \endcode The trajectory container (tng_data) * must be initialised before using it. @@ -1085,6 +1085,34 @@ tng_function_status DECLSPECDLLEXPORT tng_num_frames_get int64_t *n); /** + * @brief Get the precision of lossy compression + * @param tng_data is the trajectory of which to get the compression precision. + * @param precision will be pointing to the retrieved compression precision. + * @pre \code tng_data != 0 \endcode The trajectory container (tng_data) + * must be initialised before using it. + * @details A compression precision of 0.001 (the default) means that the + * compressed values are accurate to the third decimal. + * @return TNG_SUCCESS (0) if successful. + */ +tng_function_status DECLSPECDLLEXPORT tng_compression_precision_get + (const tng_trajectory_t tng_data, + double *precision); + +/** + * @brief Get the precision of lossy compression + * @param tng_data is the trajectory of which to set the compression precision. + * @param precision is the new compression precision. + * @pre \code tng_data != 0 \endcode The trajectory container (tng_data) + * must be initialised before using it. + * @details A compression precision of 0.001 (the default) means that the + * compressed values are accurate to the third decimal. + * @return TNG_SUCCESS (0) if successful. + */ +tng_function_status DECLSPECDLLEXPORT tng_compression_precision_set + (tng_trajectory_t tng_data, + const double precision); + +/** * @brief Set the number of particles, in the case no molecular system is used. * @param tng_data is the trajectory of which to get the number of particles. * @param n is the number of particles to use. @@ -2645,8 +2673,9 @@ tng_function_status DECLSPECDLLEXPORT tng_time_get_str * @param filename is a string containing the name of the trajectory to open. * @param mode specifies the file mode of the trajectory. Can be set to 'r', * 'w' or 'a' for reading, writing or appending respectively. - * @param tng_data_p is a pointer to the opened trajectory. This must be - * closed by the user. + * @param tng_data_p is a pointer to the opened trajectory. This will be + * allocated by the TNG library. The trajectory must be + * closed by the user, whereby memory is freed. * @pre \code tng_data != 0 \endcode The trajectory container (tng_data) * must be initialised before using it. * @pre \code filename != 0 \endcode The pointer to the filename must not be a |