Hi, I'm trying to run a model-free calculation in relax 2.2.3 on a cluster, set up with mpi4py and Open MPI as described in the documentation. I ran the job with 64 cores, and this was successfully picked up by the software:
Processor fabric: MPI 2.1 running via mpi4py with 63 space processors & 1 master. Using Open MPI 1.4.1. However, when the job finished an analysis of the CPU time used showed that only 11 or 12 cores were actually being used for computations, which I presume correlates with the number of cores per node. Indeed, when I ran another test using 12 cores over nodes containing 4 cores, only 3 cores were active during the calculation. Is there an error in my set up, or is this some kind of bug? Best wishes, Chris Waudby [email protected] _______________________________________________ relax (http://www.nmr-relax.com) This is the relax-users mailing list [email protected] To unsubscribe from this list, get a password reminder, or change your subscription options, visit the list information page at https://mail.gna.org/listinfo/relax-users
