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SYCL build for GROMACS

Ducki
Beginner
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Dear Intel Support Team,

I would like to have GPU support for GROMACS, my GPU is Intel Iris Xe Graphics, so I was recommended to use SYCL support. However, installing all the Intel oneAPI Base Toolkit is quite heavy (approximately 22GB). So I would like to ask are there some required components in the Toolkit that i really need to install for SYCL-GROMACS complete building without errors? I'm using Ubuntu 22.04 by the way if it helps to clarify.

Sincerely.

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RahulC_Intel
Moderator
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Hi Ducky, please note that you need to install only DPC++/ C++ Intel® oneAPI component for SYCL programming. You may refer to the link: https://www.intel.com/content/www/us/en/developer/articles/release-notes/intel-oneapi-dpc-c-compiler-release-notes.html and check the updated release notes for Intel® oneAPI DPC++/C++ Compiler.

 

 

 

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RahulC_Intel
Moderator
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Hi Ducky, we have moved your query to respective team and they will get back to you soon on another community thread link: https://community.intel.com/t5/Intel-oneAPI-Data-Parallel-C/bd-p/oneapi-data-parallel-c

 

If you have any further queries, please post a new question as this thread will no longer be monitored by Intel®.

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