The open framework for on-the-fly off-lattice kinetic Monte Carlo simulations.
☆16Mar 11, 2024Updated 2 years ago
Alternatives and similar repositories for openFLY
Users that are interested in openFLY are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A force field for the simulation of inorganic-organic interfaces (INTERFACE-CHARMM, INTERFACE-PCFF)☆25Feb 14, 2024Updated 2 years ago
- PAPRECA hybrid off-lattice kinetic Monte Carlo/molecular dynamics (kMC/MD) simulator☆23Aug 23, 2026Updated last month
- 🦜 DISCOTRESS 🦜 is a software package to simulate and analyse the dynamics on arbitrary Markov chains☆27Jul 29, 2021Updated 5 years ago
- Kinetic Monte Carlo of Systems (KMCOS): lattice based kinetic Monte Carlo with a python front-end and Fortran back-end.☆24Jun 22, 2025Updated last year
- This repository contains reference data from the Richardson Lab at Duke.☆17Updated 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.
- Accelerating Metadynamics-Based Free-Energy Calculations with Adaptive Machine Learning Potentials☆18Jun 9, 2021Updated 5 years ago
- A split 34-key board with pinky clusters☆12Oct 20, 2022Updated 3 years ago
- A set of python scripts for automating iterative the iterative Boltzmann inversion method using LAMMPS.☆14Jun 10, 2015Updated 11 years ago
- Python code for phase identification and spectrum analysis of energy dispersive x-ray spectroscopy (EDS)☆26Nov 15, 2023Updated 2 years ago
- Mini-applications that exclusively use the Kokkos programming model☆12Mar 21, 2023Updated 3 years ago
- Python package for efficient analysis of HILLS files generated by Plumed metadynamics simulations. Inspired by the Metadynminer package f…☆22Feb 2, 2026Updated 7 months ago
- Defunctionalised higher-kinded polymorphism in OCaml.☆20Oct 13, 2020Updated 5 years ago
- Illustrating how to publish battery data☆13May 27, 2025Updated last year
- Neural force field learning toolkit☆14Jul 17, 2026Updated 2 months 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.
- A pseudo random number generator library written against the SYCL API.☆11Jun 11, 2019Updated 7 years ago
- The repository contains container recipes to build the entire stack of Xeus-Cling and Cling including cuda extension with just a few comm…☆10Dec 22, 2020Updated 5 years ago
- ☆12Feb 14, 2024Updated 2 years ago
- kMC on steroids: A vigorous attempt to make lattice kinetic Monte Carlo modelling easier☆66Feb 1, 2026Updated 7 months ago
- Multiprocessor Algorithms for Nonlinear Gradient-free Optimization☆12Jul 1, 2020Updated 6 years ago
- wxPython sample apps and demos☆18Jun 10, 2020Updated 6 years ago
- Standard interface for collecting HPC run metadata☆16Sep 9, 2026Updated 2 weeks ago
- DARMA/magistrate => Serialization and checkpointing library☆12Sep 15, 2026Updated last week
- Python library written in C++ for calculation of local atomic structural environment☆70Apr 30, 2026Updated 4 months ago
- 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.
- Quasistatic plasma wakefield simulation code for GPUs in well under 1000 lines of code.☆13May 7, 2019Updated 7 years ago
- A tool for finding optimized SQS structures tool written in C++☆79Aug 12, 2026Updated last month
- MFMG is an open-source library implementing matrix-free multigrid methods.☆18Oct 4, 2019Updated 6 years ago
- Performance-portable C++ code for simulating elastic shear waves in an axisymmetric domain.☆12Jan 30, 2022Updated 4 years ago
- An introduction course about scientific computing and research for the first year undergraduates taught at Fudan University.☆10Updated this week
- List all available information about all SYCL devices and platforms☆15Sep 14, 2020Updated 6 years ago
- Standalone Patatrack pixel tracking☆19Sep 11, 2026Updated 2 weeks ago
- An alternative to Boost.MPI for a user friendly C++ interface for MPI (MPICH).☆19Feb 24, 2018Updated 8 years ago
- Structured PIC proxy app based on Cabana☆15Jun 30, 2025Updated last year
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- A lightweight, object-oriented C++ library that contains a general framework for creating custom kinetic Monte Carlo simulation software …☆25Aug 29, 2020Updated 6 years ago
- Tools and libraries for writing Kokkos-enabled HPC C++ in E3SM ecosystem☆22Updated this week
- 34-key split keyboard with pinky clusters☆25Aug 1, 2022Updated 4 years ago
- Dynamic execution environments for coupled, thread-heterogeneous MPI+X applications☆23Aug 10, 2026Updated last month
- MatID is a Python package for identifying and analyzing atomistic systems based on their structure.☆14Jul 6, 2026Updated 2 months ago
- Data and reproducibility scripts for the UoB-HPC Performance Portability studies☆18May 23, 2024Updated 2 years ago
- Package for reading, analysis and visualization of metadynamics HILLS☆41Nov 28, 2023Updated 2 years ago