On Fri, Oct 16, 2015 at 2:51 PM, Novosielski, Ryan
<novosirj.ca.rutgers.edu> wrote:
>
> Thanks. Then I guess doing a serial build and then building over the top with OpenMP to only replace those parts that support OpenMP is a good solution? Thanks again!
The OpenMP build of cpptraj doesn't actually replace the serial
binary; they are two separate entities (cpptraj and cpptraj.OMP). I
think that nab does get replaced (although I may be wrong about that).
-Dan
>
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--
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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
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Received on Fri Oct 16 2015 - 14:30:02 PDT
