[gmx-developers] Any news on SIMD intrinsic accelerated kernel for Blue Gene/Q?

[Bin Liu]

Dear developers,


In the GROMACS acceleration and parallelization webpage, I found

*We will add Blue Gene P and/or Q and AVX2 in the near future.*

I am quite excited about this news, since I am a researcher in Canada, and
the University of Toronto has purchased a Blue Gene Q cluster which will be
operated under Scinet Consortium.

https://support.scinet.utoronto.ca/wiki/index.php/BGQ#System_Status:_BETA

Without the SIMD intrinsic accelerated kernel for Blue Gene/Q, perhaps they
won't install GROMACS on it since a lot of computational resources are
going to be wasted. If the GROMACS developer can implement  the SIMD
intrinsic accelerated kernel, I will be more than grateful for that.


Bin
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