Posts by Mittul Singh
Installing AMD HIP-Enabled GROMACS on HPC Systems: A LUMI Supercomputer Case Study
- 12 January 2026
Running molecular dynamics (MD) simulations efficiently is critical for accelerating scientific discovery in many life science use cases, e.g., drug discovery. GROMACS is a widely used, GPU-accelerated molecular dynamics engine powering many life science workflows, but its performance can vary significantly depending on the installation method and hardware configuration. For broader context on GROMACS applications in drug design, see recent research on GROMACS in cloud environments for alchemical drug design.
3D Scene Reconstruction from the Inside: Explore the Mathematics Behind gsplat
- 16 December 2025
3D Gaussian Splatting (3DGS) reconstructs 3D scenes from multiple 2D images and renders novel views in real time. In this blog, which serves as a follow up to a previous post, Elevating 3D Scene Rendering with GSplat, you will learn the core mathematics and the practical library components behind 3DGS using gsplat.