[gmx-users] mpi version
spoel at xray.bmc.uu.se
Wed Sep 24 20:04:01 CEST 2003
On Wed, 2003-09-24 at 19:59, Ilya Chorny wrote:
> I compiled the fftw and used the RPM for the LAM. So you are saying I
> should recompile the LAM?
Yes, and please use fftw 2.1.5 since v. 3.0 is not supported yet.
> On Wed, 2003-09-24 at 10:15, Erik Lindahl wrote:
> > On Wednesday, September 24, 2003, at 10:09 AM, Ilya Chorny wrote:
> > > I still don't really understand what to do. I installed the newest
> > > version of the LAM, and the most up to date version of fftw with mpi
> > > support. What should I do next.
> > >
> > Did you *install* them, or *compile* them?
> > If you just picked up binaries you MUST use exactly the same version as
> > was used to compile fftw and gromacs, or compile the programs yourself.
> > LAM-MPI does not guarantee cross-version compatibility.
> > Cheers,
> > Erik
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David van der Spoel, PhD, Assist. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
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