diff options
| -rw-r--r-- | src/lib/tng_io.c | 15 |
1 files changed, 10 insertions, 5 deletions
diff --git a/src/lib/tng_io.c b/src/lib/tng_io.c index d224679..536403d 100644 --- a/src/lib/tng_io.c +++ b/src/lib/tng_io.c @@ -7055,7 +7055,8 @@ tng_function_status DECLSPECDLLEXPORT tng_molecule_w_id_add if(tng_data->molecules[i].id == id) { stat = TNG_FAILURE; - printf("TNG library: Molecule ID already in use. %s: %d\n", __FILE__, __LINE__); + printf("TNG library: Molecule ID %"PRId64" already in use. %s: %d\n", id, + __FILE__, __LINE__); break; } } @@ -9790,21 +9791,25 @@ tng_function_status DECLSPECDLLEXPORT tng_time_per_frame_set (tng_trajectory_t tng_data, const double time) { -/* tng_trajectory_frame_set_t frame_set;*/ + tng_trajectory_frame_set_t frame_set; TNG_ASSERT(tng_data, "TNG library: Trajectory container not properly setup."); TNG_ASSERT(time >= 0, "TNG library: The time per frame must be >= 0."); -/* frame_set = &tng_data->current_trajectory_frame_set;*/ + if(time == tng_data->time_per_frame) + { + return(TNG_SUCCESS); + } + + frame_set = &tng_data->current_trajectory_frame_set; /* If the current frame set is not finished write it to disk before changing time per frame. */ -/* if(frame_set->n_unwritten_frames > 0) + if(tng_data->time_per_frame > 0 && frame_set->n_unwritten_frames > 0) { frame_set->n_frames = frame_set->n_unwritten_frames; tng_frame_set_write(tng_data, TNG_USE_HASH); } -*/ tng_data->time_per_frame = time; return(TNG_SUCCESS); |