Re: [AMBER] Experiences with GTX 780 in the framework of Amber calculations ?

From: Gould, Ian R <i.gould.imperial.ac.uk>
Date: Thu, 20 Jun 2013 14:05:55 +0000

Not right at this moment as they are running some time limited
calculations but I will do so once the jobs have finished in a couple of
days.

Cheers
Ian

Women love us for our defects. If we have enough of them, they will
forgive us everything, even our intellects.
Oscar Wilde
-- 
Dr Ian R Gould, FRSC.
Reader in Computational Chemical Biology
Department of Chemistry
Imperial College London
Exhibition Road
London
SW7 2AY
E-mail i.gould.imperial.ac.uk
http://www3.imperial.ac.uk/people/i.gould
Tel +44 (0)207 594 5809
On 20/06/2013 14:33, "ET" <sketchfoot.gmail.com> wrote:
>. Ian,
>
>Hi.
>
>I am also very interested in whether your TITANS passed the
>reproducibility  test. Can you run 2x AMBER benchmarks with the same ig
>value and get identical results?
>
>br,
>g
>
>
>On 19 June 2013 20:58, filip fratev <filipfratev.yahoo.com> wrote:
>
>> Hi Ian,
>> I use Titan Gigabyte too and one of my two cards has described problems
>> here. Thus I don't think that this is only EVGA problem.
>>
>> Regards,
>> Filip
>>
>>
>>
>>
>> ________________________________
>>  From: Scott Le Grand <varelse2005.gmail.com>
>> To: AMBER Mailing List <amber.ambermd.org>
>> Sent: Wednesday, June 19, 2013 9:39 PM
>> Subject: Re: [AMBER] Experiences with GTX 780 in the framework of Amber
>> calculations ?
>>
>>
>> It most certainly could be that.  But again, still not enough
>>information
>> for any conclusions yet.
>>
>>
>>
>> On Wed, Jun 19, 2013 at 11:34 AM, Gould, Ian R <i.gould.imperial.ac.uk
>> >wrote:
>>
>> > Dear All
>> >
>> > I am running 4 stock Titan Gigabyte GTX TITAN's and have not had any
>> > problems with them and they have been running flat out for a while.
>>From
>> > all the bandwidth on this issue could it be something specific to the
>> > EVGA? Does anyone have experience with the ASUS, GAINWARD or ZOTAC
>> Titans?
>> >
>> > Cheers
>> > Ian
>> >
>> > Women love us for our defects. If we have enough of them, they will
>> > forgive us everything, even our intellects.
>> > Oscar Wilde
>> > --
>> > Dr Ian R Gould, FRSC.
>> > Reader in Computational Chemical Biology
>> > Department of Chemistry
>> > Imperial College London
>> > Exhibition Road
>> > London
>> > SW7 2AY
>> > E-mail i.gould.imperial.ac.uk
>> > http://www3.imperial.ac.uk/people/i.gould
>> > Tel +44 (0)207 594 5809
>> >
>> >
>> >
>> >
>> > On 19/06/2013 18:35, "Marek Maly" <marek.maly.ujep.cz> wrote:
>> >
>> > >Dear all,
>> > >
>> > >we (members of "Amber/Titan(ic)" club) are curious regarding
>>experiences
>> > >with GTX 780 for Amber calculations as it seems that Titan GPUs in
>> general
>> > >have some problems here - for details please see the thread:
>> > >
>> > >"experiences with EVGA GTX TITAN Superclocked - memtestG80 -
>> > >UNDERclocking
>> > >in Linux ?"
>> > >
>> > >So any  "GTX780/Amber" info would be highly appreciated. Here the
>> > >performance
>> > >is not of the main interest as e.g. Jonathan Gough, already provided
>>his
>> > >benchmarks here:
>> > >
>> > >  http://archive.ambermd.org/201306/0211.html
>> > >
>> > >
>> > >For us and perhaps also for anybody who is planning to buy new
>>non-Tesla
>> > >GPUs
>> > >for Amber simulations would be very interesting mainly STABILITY of
>>GTX
>> > >780
>> > >in Amber simulations and their ability to EXACTLY REPRODUCE  results
>>of
>> > >calculations
>> > >which are repeated under same conditions (including the same random
>> seed).
>> > >
>> > >Such information might be obtained using Amber benchmark cases, which
>> > >is possible download here: http://ambermd.org/gpus/benchmarks.htm
>> > >
>> > >Here is the example of such useful test which was done by Jonathan
>>(e.g.
>> > >each test repeat (twice is OK)). Length of each test 100 000 steps.
>> > >
>> > >http://archive.ambermd.org/201306/0207.html
>> > >
>> > >   Thanks a lot in advance !
>> > >
>> > >       Best wishes,
>> > >
>> > >          Marek
>> > >
>> > >
>> > >
>> > >
>> > >
>> > >
>> > >--
>> > >Tato zpráva byla vytvořena převratným poštovním klientem Opery:
>> > >http://www.opera.com/mail/
>> > >
>> > >_______________________________________________
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>> > >AMBER.ambermd.org
>> > >http://lists.ambermd.org/mailman/listinfo/amber
>> >
>> >
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Received on Thu Jun 20 2013 - 07:30:03 PDT
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