Basics of Accelerated Computing with Intel OpenMP GPU Offload

The Molecular Sciences Software Institute (MolSSI) and Intel invite you to attend our hands-on Basics of Accelerated Computing with Intel OpenMP GPU Offload virtual workshop on Mar. 7, 2025 from 13:00 – 17:00 ET.

The main focus of the course will be on the following topics:

  • A brief overview of OpenMP parallelization on CPUs
  • Offloading an OpenMP CPU-parallel code to GPUs
  • Managing data transfer between the host and the device within OpenMP framework
  • OpenMP GPU offload best practices
  • Overview of a real-life example in which Intel OpenMP helped community a code such as NWChem to perform compute- and data-intensive tasks more efficiently

The following prerequisites are recommended but not mandatory for attending the workshop:

  • Experience with OpenMP parallelization on CPUs
  • Basic familiarity with Bash as well as C, C++ or Fortran programming languages
  • Familiarity with Jupyter Lab environment

We have arranged a brief preparation session before the beginning of the workshop. The details of the preparation session can be found here.

Registration details:

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