On Wed, 2014-08-13 at 13:11 +0200, Pablo Ródenas wrote:
> Hi again,
>
> after reinstalling Amber14 with mvapich2/2.0 the tests results are the
> following:
> CUDA --> 90 passed, 35 failures, 0 errors
> CUDA_PARALLEL (do_parallel = 2) --> 52 passed, 35 failures, 0 errors.
>
> But the error kPMEFillChargeGridBuffer still appears after 10~20 seconds
> of execution with either pmemd.cuda and pmemd.cuda.MPI
Can you put the files somewhere where we can download them? I don't see
us being able to help any further unless we can reproduce the problem.
(Put them on dropbox or something, I doubt they're small enough to
attach to an email to the list).
Thanks,
Jason
--
Jason M. Swails
BioMaPS,
Rutgers University
Postdoctoral Researcher
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Received on Wed Aug 13 2014 - 05:00:02 PDT
