[gmx-developers] Branches w/working OpenCL support
Roland Schulz
roland at utk.edu
Fri Jun 19 09:17:21 CEST 2015
On Thu, Jun 18, 2015 at 6:34 PM, Mirco Wahab <
mirco.wahab at chemie.tu-freiberg.de> wrote:
> On 18.06.2015 23:31, Roland Schulz wrote:
> > On Thu, Jun 18, 2015 at 5:12 PM, Mirco Wahab
> > <mirco.wahab at chemie.tu-freiberg.de
> > <mailto:mirco.wahab at chemie.tu-freiberg.de>> wrote:
> >
> > Hi Mark,
> >
> > On 17.06.2015 23:31, Mark Abraham wrote:
> > > I've solved three correctness issues with the OpenCL
> implementation now,
> > > and NPT on AMD looks quite nice. Can you please try the code at
> > >https://gerrit.gromacs.org/#/c/4314/26 and let us know if the
> situation
> > > is improved?
> >
> > I tried but could not really compile under VS-2013/MSVC-18. The
> problem
> > is, as is already stated in a comment, the macro expansion into an
> > alignment declaration, which is not supported by MSVC:
> >
> >
> > This is weird. Because it works for me with VS-2013. Do you have the
> > latest Update (2013 Update 4)?
>
> Yes, Update 4. Your response suprised me. What I found out after
> further tests:
>
> cmake with -DGMX_SIMD=AVX_256 compiles fine (only an <algorithm> for
> min/max missing somewhere)
>
> cmake with -DGMX_SIMD=SSE2 fails on expansion of this said macro
> (in bonded.cpp, clincs.cpp)
>
Thanks. I didn't correctly test with SSE2 and thus thought it was OK with
2013. https://gerrit.gromacs.org/#/c/4744/ fixes it.
Roland
--
ORNL/UT Center for Molecular Biophysics cmb.ornl.gov
865-241-1537, ORNL PO BOX 2008 MS6309
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