Re: [AMBER-Developers] EP Question

From: Jason Swails <jason.swails.gmail.com>
Date: Mon, 23 Apr 2012 22:01:14 -0400

On Apr 23, 2012, at 9:38 PM, Scott Brozell <sbrozell.rci.rutgers.edu> wrote:

> Hi,
>
> On Thu, Mar 01, 2012 at 01:24:03PM -0500, Jason Swails wrote:
>> The example works for me with sander and sander.MPI and segfaults for
>> pmemd, only, is this what others are seeing?
>>
>> As for pmemd, Ben Roberts and I threw a night into hunting this down at the
>> Amber meeting without any success. The error surfaces in (I can't say it
>> starts in) extra_pnts_nb14.F90, init_extra_pnts_nb14. The segfault occurs
>> on a deallocate call (line 649) according to my debugger, but the error
>> occurs earlier. Ben and I tried a lot of things to just see where the
>> error was occurring, but the error occurred in a different place every time
>> we tried something new.
>
> Do these comments refer to bug 166 ?
> http://bugzilla.ambermd.org/show_bug.cgi?id=166

Yes.

--
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
352-392-4032
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Received on Mon Apr 23 2012 - 19:30:03 PDT
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