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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. HOOMD-blue supports efficient parallel execution and has been used for large-scale GPU-based simulations. Its main value is combining a flexible Python user experience with strong GPU performance for modern particle simulation research.
Features
- Python particle simulation workflow
- GPU-accelerated C++ and CUDA backend
- Molecular dynamics support
- Hard-particle Monte Carlo support
- Soft matter and colloidal modeling
- Scalable high-performance simulation engine
Project Samples
Categories
Molecular MechanicsLicense
BSD LicenseFollow HOOMD-blue
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