Dear GROMACS experts, (Relevant files can be found on https://copy.com/7DMkn6OxJBqEZtqh)
I have been told in the error file: ... ... Reading frame 1700 time 17000.000 Reading frame 1800 time 18000.000 Reading frame 1900 time 19000.000 Reading frame 2000 time 20000.000 -------------------------------------------------------------------------- mpirun noticed that process rank 0 with PID 31111 on node node-080 exited on signal 8 (Floating point exception). -------------------------------------------------------------------------- when I tried to submit a job with commandline below on our cluster: echo "2 2" | gerun g_rms -s md_0_1.tpr -f md_0_1.xtc Can I ask what is incorrect in my job? Thank you very much. Yours sincerely Cheng -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
