Benchmarks for my local machine (intel core i7-2600 3.4 GHz), x86_64.
Current GIT master (8685600c1b3862670b1de0549776a687c1520aea).
$AMBERHOME/benchmarks/dhfr
GNU: 5.3.1
./configure gnu
sander: 0.49 ns/day
pmemd: 1.13 ns/day
Intel: 14.0.0
./configure intel
sander: 0.55 ns/day
pmemd: 1.42 ns/day
About 1.1-1.2x - not as large as the speedup that Ross saw but still not bad.
I'll look at some cpptraj benchmarks in a bit.
-Dan
On Thu, Mar 10, 2016 at 12:53 PM, Gerald Monard
<Gerald.Monard.univ-lorraine.fr> wrote:
>
>
> On 03/10/2016 06:03 PM, David A Case wrote:
>> Could you say how much faster (for some example)? (Aside: you can use MKL
>> + gnu compilers, if that makes any difference).
>>
>> ...thx...dac
>
> I'll try to provide some benchmarks for next week.
> Best,
>
> Gerald.
>
>
> --
> ____________________________________________________________________________
>
> Prof. Gerald MONARD
> SRSMC, Université de Lorraine, CNRS
> Boulevard des Aiguillettes B.P. 70239
> F-54506 Vandoeuvre-les-Nancy, FRANCE
>
> e-mail : Gerald.Monard.univ-lorraine.fr
> tel. : +33 (0)383.684.381
> fax : +33 (0)383.684.371
> web : http://www.monard.info
>
> ____________________________________________________________________________
>
>
> _______________________________________________
> AMBER-Developers mailing list
> AMBER-Developers.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber-developers
--
-------------------------
Daniel R. Roe, PhD
Department of Medicinal Chemistry
University of Utah
30 South 2000 East, Room 307
Salt Lake City, UT 84112-5820
http://home.chpc.utah.edu/~cheatham/
(801) 587-9652
(801) 585-6208 (Fax)
_______________________________________________
AMBER-Developers mailing list
AMBER-Developers.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber-developers
Received on Thu Mar 10 2016 - 12:30:03 PST
