Re: [gmx-users] query on performance of GTX 1080 in gromacs

2016-06-18 Thread Szilárd Páll
Hi,

What do you mean by "feasibility"?

The 1080 is good, quite fast, but expensive too. It's faster than on
the TITAN X, but  ATM you need a very beefy CPU to match its
performance, i.e. at least an 8-core i7 or a 12 core Xeon (that will
change soon, but not for the next release!). Hence, the 1070 is far
better perf/buck and with our kernels it roughly matches the top
Maxwells.

BTW the Fury Nano is a decent choice too especially as it's available
and about the same cost as a 1070.

Cheers,
--
Szilárd


On Sat, Jun 18, 2016 at 11:58 AM, jagannath mondal  wrote:
> Hi Mark
>   Sorry to ask again, but is there an update on the feasibility of gromacs
> in gtx1080 ?
> Jagannath
>
> On Fri, May 27, 2016 at 10:36 PM, Mark Abraham 
> wrote:
>
>> Hi,
>>
>> Yes, we expect it to work, but we haven't tried it yet. NVIDIA didn't
>> manage to give us any early access, in practice. We have some cards, but
>> perhaps no actual run until early next week.
>>
>> Mark
>>
>> On Fri, 27 May 2016 18:22 Jagannath Mondal 
>> wrote:
>>
>> > Dear Gromacs users
>> >
>> >   I just wanted to check whether latest GPU of NVIDIA GTX 1080 has been
>> > tested by any one for its compatibility/performance with gromacs.
>> >
>> > I have used GTX 980 Ti and have found it compatible with gromacs with a
>> > significant performance boosting. I wanted to check if the latest release
>> > of NVIDIA GTX 1080 will work with Gromacs.
>> >
>> > I will appreciate your feedback.
>> >
>> > Jagannath
>> > --
>> > Gromacs Users mailing list
>> >
>> > * Please search the archive at
>> > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
>> > posting!
>> >
>> > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>> >
>> > * For (un)subscribe requests visit
>> > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
>> > send a mail to gmx-users-requ...@gromacs.org.
>> >
>> --
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>> posting!
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>>
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Re: [gmx-users] query on performance of GTX 1080 in gromacs

2016-06-18 Thread Jagannath Mondal
Hi Mark
  Sorry to ask again, but is there an update on the feasibility of gromacs
in gtx1080 ?
Jagannath

On Fri, May 27, 2016 at 10:36 PM, Mark Abraham 
wrote:

> Hi,
>
> Yes, we expect it to work, but we haven't tried it yet. NVIDIA didn't
> manage to give us any early access, in practice. We have some cards, but
> perhaps no actual run until early next week.
>
> Mark
>
> On Fri, 27 May 2016 18:22 Jagannath Mondal 
> wrote:
>
> > Dear Gromacs users
> >
> >   I just wanted to check whether latest GPU of NVIDIA GTX 1080 has been
> > tested by any one for its compatibility/performance with gromacs.
> >
> > I have used GTX 980 Ti and have found it compatible with gromacs with a
> > significant performance boosting. I wanted to check if the latest release
> > of NVIDIA GTX 1080 will work with Gromacs.
> >
> > I will appreciate your feedback.
> >
> > Jagannath
> > --
> > Gromacs Users mailing list
> >
> > * Please search the archive at
> > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> > posting!
> >
> > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
> >
> > * For (un)subscribe requests visit
> > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> > send a mail to gmx-users-requ...@gromacs.org.
> >
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
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> send a mail to gmx-users-requ...@gromacs.org.
>
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Re: [gmx-users] query on performance of GTX 1080 in gromacs

2016-06-18 Thread jagannath mondal
Hi Mark
  Sorry to ask again, but is there an update on the feasibility of gromacs
in gtx1080 ?
Jagannath

On Fri, May 27, 2016 at 10:36 PM, Mark Abraham 
wrote:

> Hi,
>
> Yes, we expect it to work, but we haven't tried it yet. NVIDIA didn't
> manage to give us any early access, in practice. We have some cards, but
> perhaps no actual run until early next week.
>
> Mark
>
> On Fri, 27 May 2016 18:22 Jagannath Mondal 
> wrote:
>
> > Dear Gromacs users
> >
> >   I just wanted to check whether latest GPU of NVIDIA GTX 1080 has been
> > tested by any one for its compatibility/performance with gromacs.
> >
> > I have used GTX 980 Ti and have found it compatible with gromacs with a
> > significant performance boosting. I wanted to check if the latest release
> > of NVIDIA GTX 1080 will work with Gromacs.
> >
> > I will appreciate your feedback.
> >
> > Jagannath
> > --
> > Gromacs Users mailing list
> >
> > * Please search the archive at
> > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> > posting!
> >
> > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
> >
> > * For (un)subscribe requests visit
> > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> > send a mail to gmx-users-requ...@gromacs.org.
> >
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
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> send a mail to gmx-users-requ...@gromacs.org.
>
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Re: [gmx-users] query on performance of GTX 1080 in gromacs

2016-06-03 Thread Jagannath Mondal
Dear Mark
  Did you have a chance to test gromacs with GTX 1080? Can you please let
us know if it is compatible and working well.
Jagannath

On Sat, May 28, 2016 at 2:36 PM, Jagannath Mondal 
wrote:

> Dear Mark
>
>I will appreciate if you share your experience, once you tested with
> GTX 1080. I can wait for your response.
>
> Jagannath
>
>
> On Fri, May 27, 2016 at 10:36 PM, Mark Abraham 
> wrote:
>
>> Hi,
>>
>> Yes, we expect it to work, but we haven't tried it yet. NVIDIA didn't
>> manage to give us any early access, in practice. We have some cards, but
>> perhaps no actual run until early next week.
>>
>> Mark
>>
>> On Fri, 27 May 2016 18:22 Jagannath Mondal 
>> wrote:
>>
>> > Dear Gromacs users
>> >
>> >   I just wanted to check whether latest GPU of NVIDIA GTX 1080 has been
>> > tested by any one for its compatibility/performance with gromacs.
>> >
>> > I have used GTX 980 Ti and have found it compatible with gromacs with a
>> > significant performance boosting. I wanted to check if the latest
>> release
>> > of NVIDIA GTX 1080 will work with Gromacs.
>> >
>> > I will appreciate your feedback.
>> >
>> > Jagannath
>> > --
>> > Gromacs Users mailing list
>> >
>> > * Please search the archive at
>> > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
>> > posting!
>> >
>> > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>> >
>> > * For (un)subscribe requests visit
>> > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
>> > send a mail to gmx-users-requ...@gromacs.org.
>> >
>> --
>> Gromacs Users mailing list
>>
>> * Please search the archive at
>> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
>> posting!
>>
>> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>>
>> * For (un)subscribe requests visit
>> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
>> send a mail to gmx-users-requ...@gromacs.org.
>>
>
>
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Re: [gmx-users] query on performance of GTX 1080 in gromacs

2016-05-28 Thread Jagannath Mondal
Dear Mark

   I will appreciate if you share your experience, once you tested with GTX
1080. I can wait for your response.

Jagannath


On Fri, May 27, 2016 at 10:36 PM, Mark Abraham 
wrote:

> Hi,
>
> Yes, we expect it to work, but we haven't tried it yet. NVIDIA didn't
> manage to give us any early access, in practice. We have some cards, but
> perhaps no actual run until early next week.
>
> Mark
>
> On Fri, 27 May 2016 18:22 Jagannath Mondal 
> wrote:
>
> > Dear Gromacs users
> >
> >   I just wanted to check whether latest GPU of NVIDIA GTX 1080 has been
> > tested by any one for its compatibility/performance with gromacs.
> >
> > I have used GTX 980 Ti and have found it compatible with gromacs with a
> > significant performance boosting. I wanted to check if the latest release
> > of NVIDIA GTX 1080 will work with Gromacs.
> >
> > I will appreciate your feedback.
> >
> > Jagannath
> > --
> > Gromacs Users mailing list
> >
> > * Please search the archive at
> > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> > posting!
> >
> > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
> >
> > * For (un)subscribe requests visit
> > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> > send a mail to gmx-users-requ...@gromacs.org.
> >
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
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> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-requ...@gromacs.org.
>
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Re: [gmx-users] query on performance of GTX 1080 in gromacs

2016-05-27 Thread Mark Abraham
Hi,

Yes, we expect it to work, but we haven't tried it yet. NVIDIA didn't
manage to give us any early access, in practice. We have some cards, but
perhaps no actual run until early next week.

Mark

On Fri, 27 May 2016 18:22 Jagannath Mondal  wrote:

> Dear Gromacs users
>
>   I just wanted to check whether latest GPU of NVIDIA GTX 1080 has been
> tested by any one for its compatibility/performance with gromacs.
>
> I have used GTX 980 Ti and have found it compatible with gromacs with a
> significant performance boosting. I wanted to check if the latest release
> of NVIDIA GTX 1080 will work with Gromacs.
>
> I will appreciate your feedback.
>
> Jagannath
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-requ...@gromacs.org.
>
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[gmx-users] query on performance of GTX 1080 in gromacs

2016-05-27 Thread Jagannath Mondal
Dear Gromacs users

  I just wanted to check whether latest GPU of NVIDIA GTX 1080 has been
tested by any one for its compatibility/performance with gromacs.

I have used GTX 980 Ti and have found it compatible with gromacs with a
significant performance boosting. I wanted to check if the latest release
of NVIDIA GTX 1080 will work with Gromacs.

I will appreciate your feedback.

Jagannath
-- 
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