Re: [AMBER-Developers] Amber12 release candidate 2: rism hang

From: David A. Case <case.biomaps.rutgers.edu>
Date: Tue, 27 Mar 2012 20:55:42 -0400

On Tue, Mar 27, 2012, Scott Brozell wrote:
>
> Same platform but with MKL: now spc-kh and spc-psen hang
> and tip3p-kh gives the error.
> (spc-hnc passes.)
>
> It's clear that there is a memory bug somewhere.
>
> > > > > Red Hat 6.1, Intel 12.1.0, No MKL, x86_64, Only AmberTools serial 3/22/12 SRB

Do we have any clues about what might be special about Scott's system, e.g.
why Jason's reports (Ubuntu 10.04, Intel 12.1.0) don't show any similar
errors?

Intel 11.1 (with or without MKL) don't fail. Sounds like it may be up to
Scott to debug, until we can figure out ways to get the failures to appear on
other platforms, but suggestions are welcome.

....dac


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Received on Tue Mar 27 2012 - 18:00:03 PDT
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