Re: [AMBER] Error: invalid configuration argument launching kernel kPMEFillChargeGridBuffer

From: Pablo Ródenas <pablo.rodenas.bsc.es>
Date: Thu, 04 Sep 2014 08:17:05 +0200

Good morning,

could you reproduce the problem with the files provided?

Thanks,
Pablo.


On 08/13/2014 03:31 PM, Pablo Ródenas wrote:
> Dear Jason,
>
> here you have the link with the input files:
> https://www.dropbox.com/sh/vruuvddeg4fxgi8/AACmg2zJ1mwtOhxn-7N2_HQTa
>
> If you need any other information, do not hesitate to ask for it.
>
> Many thanks for your help and your time.
>
> Best regards,
> Pablo.
>
>
> On 08/13/2014 01:56 PM, Jason Swails wrote:
>> 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
>>
> 

-- 
Pablo Ródenas Barquero (pablo.rodenas.bsc.es)
BSC - Centro Nacional de Supercomputación
C/ Jordi Girona, 31    WWW: http://www.bsc.es
08034 Barcelona, Spain Tel: +34-93-405 42 29
e-mail: support.bsc.es Fax: +34-93-413 77 21
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Received on Wed Sep 03 2014 - 23:30:02 PDT
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