This webinar gives an overview of the new features that have been included in the recently released 2023 version of GROMACS. There have mainly been improvements related to performance on GPUs, in particular a new SYCL backend targeting AMD and Intel GPUs, (experimental) support for the new CUDA graphs framework and parallel PME decomposition on GPUs.
Date: 25 April 2023
Time: 15:00 – 16:00 CEST
About the author
Researcher at PDC Center for High Performance Computing at KTH Royal Institute of Technology and BioExcel Manager.
