diff options
Diffstat (limited to 'src/lib/tng_io.h')
| -rw-r--r-- | src/lib/tng_io.h | 7 |
1 files changed, 4 insertions, 3 deletions
diff --git a/src/lib/tng_io.h b/src/lib/tng_io.h index 9fa13b2..031ca65 100644 --- a/src/lib/tng_io.h +++ b/src/lib/tng_io.h @@ -287,12 +287,13 @@ typedef enum {TNG_GENERAL_INFO, TNG_TRAJECTORY_FRAME_SET, TNG_PARTICLE_MAPPING} tng_non_trajectory_block_ids; -/** Block IDs of standard trajectory blocks. Box shape can be either a - * trajectory block or a non-trajectory block */ +/** Block IDs of standard trajectory blocks. Box shape and partial charges can + * be either trajectory blocks or non-trajectory blocks */ typedef enum {TNG_TRAJ_BOX_SHAPE = 10000, TNG_TRAJ_POSITIONS, TNG_TRAJ_VELOCITIES, - TNG_TRAJ_FORCES} tng_trajectory_block_ids; + TNG_TRAJ_FORCES, + TNG_TRAJ_PARTIAL_CHARGES} tng_trajectory_block_ids; /** Flag to specify if a data block contains data related to particles or not.*/ typedef enum {TNG_NON_PARTICLE_BLOCK_DATA, |