diff options
Diffstat (limited to 'src')
| -rw-r--r-- | src/lib/tng_io.c | 2 | ||||
| -rw-r--r-- | src/tests/tng_io_read_pos.c | 7 |
2 files changed, 6 insertions, 3 deletions
diff --git a/src/lib/tng_io.c b/src/lib/tng_io.c index e6f2956..fd44205 100644 --- a/src/lib/tng_io.c +++ b/src/lib/tng_io.c @@ -5573,7 +5573,7 @@ tng_function_status tng_chain_name_of_particle_nr_get { return(TNG_FAILURE); } - if(!atom->residue || atom->residue->chain) + if(!atom->residue || !atom->residue->chain) { return(TNG_FAILURE); } diff --git a/src/tests/tng_io_read_pos.c b/src/tests/tng_io_read_pos.c index a67f14c..af5e828 100644 --- a/src/tests/tng_io_read_pos.c +++ b/src/tests/tng_io_read_pos.c @@ -27,7 +27,7 @@ int main(int argc, char **argv) int64_t particle = 0; // Set a default frame range int first_frame = 0, last_frame = 50; - char atom_name[64], res_name[64]; + char atom_name[64], res_name[64], chain_name[64]; if(argc <= 1) { @@ -70,9 +70,12 @@ int main(int argc, char **argv) TNG_SUCCESS && tng_residue_name_of_particle_nr_get(traj, particle, res_name, sizeof(res_name)) == + TNG_SUCCESS && + tng_chain_name_of_particle_nr_get(traj, particle, chain_name, + sizeof(chain_name)) == TNG_SUCCESS) { - printf("Particle: %s (%s)\n", atom_name, res_name); + printf("Particle: %s (%s: %s)\n", atom_name, chain_name, res_name); } else { |