Molecular dynamics and Monte Carlo soft matter simulation on GPUs.
☆454Oct 14, 2026Updated this week
Alternatives and similar repositories for hoomd-blue
Users that are interested in hoomd-blue are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Powerful, efficient particle trajectory analysis in scientific Python.☆331Oct 11, 2026Updated last week
- HOOMD-blue example scripts.☆40Oct 10, 2026Updated last week
- Workflow management for signac-managed data spaces.☆49Jul 9, 2026Updated 3 months ago
- Read and write GSD files for use with HOOMD-blue.☆32Updated this week
- A HOOMD-blue component for soft matter simulations.☆27Updated this week
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- Monte Carlo and Molecular dynamics soft matter simulations in Rust.☆22Updated this week
- Manage large and heterogeneous data spaces on the file system.☆147Oct 11, 2026Updated last week
- A VMD molfile plugin reader for HOOMD-blue GSD files.☆21Oct 5, 2026Updated last week
- Publication quality path tracing in real time.☆128Updated this week
- Flexible storage of chemical topology for molecular simulation☆73Oct 6, 2026Updated last week
- Rapidly visualize signac projects through a customizable dashboard interface.☆16Oct 11, 2026Updated last week
- A hierarchical, component based molecule builder☆231Updated this week
- A library to generate numerical descriptions of particle systems.☆13Aug 16, 2021Updated 5 years ago
- Differentiable, Hardware Accelerated, Molecular Dynamics☆1,465Aug 18, 2026Updated 2 months ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Public development project of the LAMMPS MD software package☆3,099Updated this week
- A plugin that allows the use of Tensorflow in Hoomd-Blue for GPU-accelerated ML+MD☆33Aug 3, 2024Updated 2 years ago
- The ESPResSo package☆273Sep 28, 2026Updated 2 weeks ago
- Fortran and Python examples to accompany the book "Computer Simulation of Liquids" by Michael P. Allen and Dominic J. Tildesley (2nd edit…☆346Mar 22, 2026Updated 6 months ago
- OpenMM is a toolkit for molecular simulation using high performance GPU code.☆2,000Updated this week
- Conda recipes for Glotzer Lab software on HPC resources☆11Sep 22, 2026Updated 3 weeks ago
- ☆19Nov 26, 2022Updated 3 years ago
- End-To-End Molecular Dynamics (MD) Engine using PyTorch☆721Apr 21, 2026Updated 5 months ago
- Collection of tools to help initialize and manipulate geometries in two and three dimensions.☆26Oct 11, 2026Updated last week
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies☆324Nov 17, 2025Updated 11 months ago
- Physical validation of molecular simulations☆66Oct 5, 2026Updated last week
- Event-driven molecular dynamics simulations for hard spheres☆19May 4, 2026Updated 5 months ago
- Development version of plumed 2☆520Updated this week
- The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation avai…☆418Updated this week
- An open library for the analysis of molecular dynamics trajectories☆738Updated this week
- A lightweight package with the periodic table of the elements☆12Apr 1, 2021Updated 5 years ago
- Molecular simulation in Julia☆497Updated this week
- Public/backup repository of the GROMACS molecular simulation toolkit. Please do not mine the metadata blindly; we use https://gitlab.com/…☆969Updated this week
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- An open-source Python package for creating fast and accurate interatomic potentials.☆364Sep 28, 2026Updated 2 weeks ago
- Quickly generate, start and analyze benchmarks for molecular dynamics simulations.☆84Sep 5, 2024Updated 2 years ago
- A batteries-included toolkit for the GPU-accelerated OpenMM molecular simulation engine.☆342Oct 9, 2026Updated last week
- A package for atom-typing as well as applying and disseminating forcefields☆149Updated this week
- Monte Carlo and Molecular Dynamics Simulation Package☆95Jul 20, 2024Updated 2 years ago
- Packmol - Initial configurations for molecular dynamics simulations☆382May 27, 2026Updated 4 months ago
- A Framework for Metropolis Monte Carlo Simulation of Molecular Systems☆72Mar 10, 2026Updated 7 months ago