Re: [AMBER] GeForce GTX 960 ?

From: Marek Maly <marek.maly.ujep.cz>
Date: Fri, 22 Apr 2016 00:36:45 +0200

Hello Ross,

thank you for this optimistic answer !

  AMBER Tools 15 + AMBER 14 already installed there
(I did this update on 7th April 2016).

  In the rest of computers we have old GeForce GTX 470 GPUs. Do you think,
that they will be able to work with CUDA 7.5 + driver 352.68 as well to
allow us to have/use just one Amber14 compilation for the whole lab or
will be better
to stay in case of GeForce GTX 470 GPUs with the actual (nicely working)
setting i.e.

Driver Version: 319.37
Cuda compilation tools, release 5.5, V5.5.0

and so have 2 different Amber compilations for this lab (one for GTX 470
and older Cuda/driver
and the second for those 3 PCs with GTX 960 and Cuda 7.5/driver 352.68)?

    Thank you,

       Best wishes,

            Marek






Dne Thu, 21 Apr 2016 19:18:30 +0200 Ross Walker <ross.rosswalker.co.uk>
napsal/-a:

> Hi Marek,
>
> You need to upgrade to AMBER Tools 15 + AMBER 14 - then have configure
> download and apply all the latest updates.
>
> Then compile with CUDA 7.5 (5.5 will NOT work for Maxwell cards which is
> what the GTX960 is) and I'd suggest upgrading the driver to 352.68. You
> should then be good.
>
> All the best
> Ross
>
>> On Apr 21, 2016, at 8:51 AM, Marek Maly <marek.maly.ujep.cz> wrote:
>>
>> Hi all,
>>
>> In one our PC-lab were upgraded 3 computers (including GPUs)
>> unfortunately
>> without noticing me, so the new GPUs are there GeForce GTX 960.
>>
>> I am using there Amber14 (actual).
>>
>> When I tried to run it on one of those 3 upgraded machines I have
>> obtained
>> error :
>>
>> "cudaMemcpyToSymbol: SetSim copy to cSim failed invalid device symbol"
>>
>> On this machine we have:
>>
>> Driver Version: 346.47
>> Cuda compilation tools, release 5.5, V5.5.0
>>
>>
>> Amber was compiled on machine with:
>>
>> Driver Version: 319.37
>> Cuda compilation tools, release 5.5, V5.5.0
>>
>>
>> Before I try to complie Amber directly on machine with GTX 960
>> (which in my opinion will not help) I would like to ask if anybody
>> has experience with Amber calculation using this GPU and eventually
>> which Cuda version/driver he is using.
>>
>>
>> It is true, that "GeForce GTX 960" is not explicitly listed in
>> Amber GPU www page ( http://ambermd.org/gpus/#supported_gpus ), on the
>> other hand there
>> is written that in Amber14 was added "Support for latest generation
>> Maxwell GPUs (GTX9XX, GTX-Titan-X)"
>>
>> So I am not sure if GTX 960 is here. Please let me know if there is
>> chance
>> to use "GeForce GTX 960" for Amber14 calculations.
>>
>> Thank you in advance,
>>
>> Baest wishes,
>>
>> Marek
>>
>>
>>
>>
>>
>>
>>
>>
>>
>> --
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Received on Thu Apr 21 2016 - 16:00:03 PDT
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