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HOOMD-blue

Molecular dynamics and Monte Carlo soft matter simulation on GPUs

HOOMD-blue is a Python-driven particle simulation engine for molecular dynamics and hard-particle Monte Carlo simulations. It was designed from the ground up for GPU acceleration, with a high-performance C++ and CUDA backend. The software is especially useful for nano-scale, colloidal, polymer, soft matter, and materials simulations. Its Python interface lets users build simulation and analysis workflows using familiar scientific Python tools.

Downloads: 0 This Week

Last Update: 2026-06-24
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