mdrun-crash
| Topic | Replies | Views | Activity | |
|---|---|---|---|---|
| System blowing up in decoupled ligand (in protein complex) simulation for ABFE calculations |
|
7 | 22 | September 30, 2022 |
| Fatal error: Setting the number of thread-MPI ranks is only supported with thread-MPI and GRO |
|
0 | 75 | July 22, 2022 |
| Issue with segmentation fault |
|
0 | 303 | February 15, 2022 |
| Error: X particles communicated to PME rank N |
|
1 | 104 | November 16, 2021 |
| Continuing simulation with cpt file after a crash |
|
2 | 299 | June 26, 2021 |
| Error after restarting: particles communicated to PME rank 0 are more than 2/3 times the cut-off |
|
0 | 133 | May 27, 2021 |