I attempted to do a restart of an aborted mpirun 4.5.4 simulation with -deffnm but no explicit -cpi. However, the simulation did not restart from the checkpoint but started from 0. Is this a known issue? Do restarts require explicit -cpi flag? (since the workflow I use to extend a run using tpbconv -extend uses -cpi on a different checkpoint filename and I know that does start the new run from the explicit checkpoint).
-- ================================================================== Peter C. Lai | University of Alabama-Birmingham Programmer/Analyst | KAUL 752A Genetics, Div. of Research | 705 South 20th Street [email protected] | Birmingham AL 35294-4461 (205) 690-0808 | ================================================================== -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [email protected]. Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
