diff options
| -rw-r--r-- | include/tng_io.h | 21 |
1 files changed, 17 insertions, 4 deletions
diff --git a/include/tng_io.h b/include/tng_io.h index 07b5421..8622596 100644 --- a/include/tng_io.h +++ b/include/tng_io.h @@ -373,14 +373,21 @@ typedef enum {TNG_NO_HASH, /** Non trajectory blocks come before the first frame set block */ typedef enum {TNG_NON_TRAJECTORY_BLOCK, TNG_TRAJECTORY_BLOCK} tng_block_type; -/** Block IDs of standard non trajectory blocks. */ +/** @defgroup def1 Standard non-trajectory blocks + * Block IDs of standard non-trajectory blocks. + * @{ + */ #define TNG_GENERAL_INFO 0x0000000000000000LL #define TNG_MOLECULES 0x0000000000000001LL #define TNG_TRAJECTORY_FRAME_SET 0x0000000000000002LL #define TNG_PARTICLE_MAPPING 0x0000000000000003LL +/** @} */ -/** Block IDs of standard trajectory blocks. Box shape and partial charges can - * be either trajectory blocks or non-trajectory blocks */ +/** @defgroup def2 Standard trajectory blocks + * Block IDs of standard trajectory blocks. Box shape and partial charges can + * be either trajectory blocks or non-trajectory blocks + * @{ + */ #define TNG_TRAJ_BOX_SHAPE 0x0000000010000000LL #define TNG_TRAJ_POSITIONS 0x0000000010000001LL #define TNG_TRAJ_VELOCITIES 0x0000000010000002LL @@ -390,9 +397,15 @@ typedef enum {TNG_NON_TRAJECTORY_BLOCK, TNG_TRAJECTORY_BLOCK} tng_block_type; #define TNG_TRAJ_B_FACTORS 0x0000000010000006LL #define TNG_TRAJ_ANISOTROPIC_B_FACTORS 0x0000000010000007LL #define TNG_TRAJ_OCCUPANCY 0x0000000010000008LL +/** @} */ -/* GROMACS data block IDs. */ + +/** @defgroup def3 GROMACS data block IDs + * Block IDs of data blocks specific to GROMACS. + * @{ + */ #define TNG_GMX_LAMBDA 0x1000000010000000LL +/** @} */ /** Flag to specify if a data block contains data related to particles or not.*/ typedef enum {TNG_NON_PARTICLE_BLOCK_DATA, |