Dear gmx-people. I know that if you send a KILL signal do a mdrun instance running integrator = md it sets nsteps to the next NS step and exits gracefully, but I don't see it happening to minimization runs.
Is it possible to send a signal ta minimization instance of mdrun to make it exit as if nsteps was reached before convergence and write the relevant gro and trr files? Thanks! -- Elton Carvalho Tel.: +55 11 3091-6985/6922 Dept Física dos Materiais e Mecânica Instituto de Física Universidade de São Paulo P.O. Box 66318 - 05314-970 São Paulo-SP, Brazil -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users * Only plain text messages are allowed! * 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 gmx-users-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
