The LIGATE project has demonstrated groundbreaking LIGEN computations running in parallel on supercomputers LUMI, Karolina, Leonardo, and E4. A new video, created by Jakub Konvička in collaboration with Jakub Beránek, highlights advancements in computational research that enable faster and more efficient drug discovery processes.

The demo was produced for the “Urgent Computing” case study for LIGEN. An interesting aspect is that the computations are initiated through the LEXIS Platform 2 portal using the HEAppE framework with the HyperQueue tool used for the actual computations. Watch the demonstration to see how supercomputing power is utilised in drug discovery via this link.