Re: [gmx-users] mpi segmentation error in continuation of REMD simulation with gromacs 4.5.5

2013-11-08 Thread Mark Abraham
Hi, That shouldn't happen if your MPI library is working (have you tested it with other programs?) and configured properly. It's possible this is a known bug, so please let us know if you can reproduce it in the latest releases. Mark On Fri, Nov 8, 2013 at 6:55 AM, Qin Qiao qiaoqi...@gmail.com

Re: [gmx-users] mpi segmentation error in continuation of REMD simulation with gromacs 4.5.5

2013-11-08 Thread Qin Qiao
On Fri, Nov 8, 2013 at 7:18 PM, Mark Abraham mark.j.abra...@gmail.comwrote: Hi, That shouldn't happen if your MPI library is working (have you tested it with other programs?) and configured properly. It's possible this is a known bug, so please let us know if you can reproduce it in the

Re: [gmx-users] mpi segmentation error in continuation of REMD simulation with gromacs 4.5.5

2013-11-08 Thread Mark Abraham
OK, thanks. Please open a new issue at redmine.gromacs.org, describe your observations as above, and upload a tarball of your input files. Mark On Fri, Nov 8, 2013 at 2:14 PM, Qin Qiao qiaoqi...@gmail.com wrote: On Fri, Nov 8, 2013 at 7:18 PM, Mark Abraham mark.j.abra...@gmail.com wrote: