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WActiGrad: Structured Pruning for Efficient Finetuning and Inference of Large Language Models on AI Accelerators

Publications Euro-Par 2024: Parallel Processing

Portable Cross-Facility Workflows for X-Ray Ptychography

Publications SC24-W: Workshops of the International Conference for High Performance Computing, Networking, Storage and Analysis

Equilibrium and Nonequilibrium Ensemble Methods for Accurate, Precise and Reproducible Absolute Binding Free Energy Calculations

Publications Journal of Chemical Theory and Computation

LLM-Inference-Bench: Inference Benchmarking of Large Language Models on AI Accelerators

Publications SC24-W: Workshops of the International Conference for High Performance Computing, Networking, Storage and Analysis

Comet: Development of an Unstructured Mesh Direct Simulation Monte Carlo Code on GPUs

Publications AIAA Aviation Forum and Ascend 2024

Nonequilibrium Dynamics of Electron Emission from Cold and Hot Graphene Under Proton Irradiation

Publications Nano Letters

Acceleration of the Particle-in-Cell Code OSIRIS with Graphics Processing Units

Publications Journal of Plasma Physics

GPU-Accelerated Solution of the Bethe–Salpeter Equation for Large and Heterogeneous Systems

Publications Journal of Chemical Theory and Computation

The Plasmodium Falciparum NCR1 Transporter Is an Antimalarial Target that Exports Cholesterol from the Parasite’s Plasma Membrane

Publications Science Advances

Cryo-EM Structures of the Human Band 3 Transporter Indicate a Transport Mechanism Involving the Coupled Movement of Chloride and Bicarbonate Ions

Publications PLOS Biology

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