GOMC - GPU Optimized Monte Carlo is a parallel molecular simulation code designed for high-performance simulation of large systems
☆88May 13, 2026Updated last week
Alternatives and similar repositories for GOMC
Users that are interested in GOMC are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- MoSDeF-GOMC: Python software for the creation of scientific workflows for the Monte Carlo simulation engine GOMC☆17Updated this week
- MoSDeF compatible wrapper for Cassandra Monte Carlo code☆14Nov 12, 2024Updated last year
- Sample molecular simulation workflows using a MoSDeF and community tools☆17Jul 19, 2022Updated 3 years ago
- Cassandra is a Monte Carlo package to conduct atomistic simulations.☆55Nov 4, 2025Updated 6 months ago
- A collection of tools I created related to the molecular simulations package RASPA.☆12Dec 4, 2023Updated 2 years ago
- 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.
- A hierarchical, component based molecule builder☆215May 4, 2026Updated 2 weeks ago
- A package for atom-typing as well as applying and disseminating forcefields☆141Apr 27, 2026Updated 3 weeks ago
- GPU Monte Carlo Simulation Code with a taste of RASPA☆88May 13, 2026Updated last week
- Classical molecular simulation code☆170Jul 13, 2024Updated last year
- This python code creates hybrid MD/MC (NAMD/GOMC) simulations for the NVT, NPT, GCMC, and GEMC-NVT ensembles☆47Updated this week
- A lightweight package with the periodic table of the elements☆12Apr 1, 2021Updated 5 years ago
- Physical validation of molecular simulations☆65Apr 6, 2026Updated last month
- This software is a general purpose classical simulation package. Online documentation available at:☆98Updated this week
- NanoOpt: Deriving potentials for coarse-grained nanoparticles via potential-matching☆11Oct 8, 2021Updated 4 years ago
- 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.
- Input script for Monte Carlo (GCMC) simulations☆20Sep 5, 2024Updated last year
- ☆19Jun 29, 2017Updated 8 years ago
- A HOOMD-blue component for soft matter simulations.☆26May 13, 2026Updated last week
- A set of tutorials to introduce new users to mBuild☆11Jun 14, 2021Updated 4 years ago
- Python interface to the KIM API. See https://openkim.org/kim-api for more information about the KIM API.☆16Mar 6, 2026Updated 2 months ago
- HOOMD-blue example scripts.☆38Apr 27, 2026Updated 3 weeks ago
- Rapidly visualize signac projects through a customizable dashboard interface.☆16Apr 20, 2026Updated last month
- A framework for processing adsorption data and isotherm fitting☆90Mar 19, 2026Updated 2 months ago
- python simulation interface for molecular modeling☆106Jun 26, 2022Updated 3 years 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.
- Flexible storage of chemical topology for molecular simulation☆70May 1, 2026Updated 2 weeks ago
- LigParGen python package version 2.3 (beta)☆14Apr 19, 2025Updated last year
- BLaDE is a Basic Lambda Dynamics Engine for molecular dynamics based alchemical free energy calculations using multisite lambda dynamics …☆18May 2, 2026Updated 2 weeks ago
- Tools for coarse-grained molecular dynamics simulations using the SPICA force field☆13May 12, 2026Updated last week
- DESPASITO: Determining Equilibrium State and Parametrization Application for SAFT, Intended for Thermodynamic Output☆22Feb 6, 2025Updated last year
- BET Surface Identification - a program that fully implements the rouquerol criteria☆21Jun 21, 2023Updated 2 years ago
- PoreBlazer (v4.0) source code, examples, and geometric properties of porous materials calculated for the subset of 12,000 structures from…☆62Dec 29, 2023Updated 2 years ago
- zeo++ fork of the LSMO☆24Dec 19, 2022Updated 3 years ago
- An interactive structure viewer alongside its simulated diffraction pattern☆19Apr 27, 2026Updated 3 weeks ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- Create new MOFs by combining generative AI and simulation on HPC☆29Mar 20, 2026Updated 2 months ago
- Repository of the gromacstutorials webpage☆14Jan 23, 2026Updated 3 months ago
- Flexible Library of Organic Workflows and Extensible Recipes for Molecular Dynamics.☆22Apr 28, 2026Updated 3 weeks ago
- Fortran and Python examples to accompany the book "Computer Simulation of Liquids" by Michael P. Allen and Dominic J. Tildesley (2nd edit…☆343Mar 22, 2026Updated last month
- ☆25Mar 8, 2023Updated 3 years ago
- ☆45Dec 10, 2025Updated 5 months ago
- TAMkin is a post-processing toolkit for thermochemistry and kinetics analysis.☆23Nov 20, 2023Updated 2 years ago