An example of how to write a plugin for OpenMM
☆31Jan 25, 2024Updated 2 years ago
Alternatives and similar repositories for openmmexampleplugin
Users that are interested in openmmexampleplugin are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- OpenMM plugin to interface with PLUMED☆79Jan 15, 2026Updated 6 months ago
- An OpenMM plugin that implements the Alchemical Transfer Potential☆40Apr 27, 2023Updated 3 years ago
- OpenMM testbed for constant-pH methodologies.☆25Sep 20, 2021Updated 4 years ago
- Molecular simulation toolkit☆20Jun 6, 2026Updated last month
- A. Alenaizan's restricted electrostatic potential (RESP) plugin to Psi4☆37Jun 18, 2025Updated last year
- 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.
- OpenMM plugin to define forces with neural networks☆31Jan 9, 2020Updated 6 years ago
- MDToolbox.jl: A Julia package for molecular dynamics trajectories analysis and modeling of biomolecules☆23Mar 21, 2025Updated last year
- An implementation of the 3SPN2 and 3SPN2.C coarse-grained DNA forcefields in OpenMM☆19Jul 13, 2026Updated last week
- HAL's MD package: Highly Accelerated Large-scale Molecular Dynamics simulations☆24Jun 15, 2026Updated last month
- C++11/Python3 library to read/write High Speed AFM data file☆14Apr 14, 2023Updated 3 years ago
- OpenMM plugin to define forces with neural networks☆220Jun 24, 2026Updated 3 weeks ago
- ☆29Dec 1, 2020Updated 5 years ago
- A Python module for carrying out GCMC insertions and deletions of water molecules in OpenMM.☆75Jun 12, 2023Updated 3 years ago
- Lee-Ping's general purpose script for running OpenMM molecular dynamics simulations☆32May 6, 2024Updated 2 years ago
- Open source password manager - Proton Pass • AdSecurely store, share, and autofill your credentials with Proton Pass, the end-to-end encrypted password manager trusted by millions.
- An implementation of the AWSEM coarse-grained protein folding forcefield in OpenMM☆39May 28, 2025Updated last year
- ☆24Jun 16, 2025Updated last year
- [WIP] Classical atomistic simulation engine with a focus on user-friendliness and extensibility☆11Aug 8, 2023Updated 2 years ago
- Quantum Mechanical Bespoke Force Field Derivation Toolkit☆108Jul 5, 2024Updated 2 years ago
- Datasets for open forcefield parameterization and development☆11Sep 22, 2019Updated 6 years ago
- The pytram package is deprecated and no longer supported. We recommend to switch to PyEMMA☆10May 25, 2016Updated 10 years ago
- ☆10May 3, 2024Updated 2 years ago
- High level API for using machine learning models in OpenMM simulations☆176Updated this week
- Rigid Body Dynamics with OpenMM☆12May 29, 2018Updated 8 years ago
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- A batteries-included toolkit for the GPU-accelerated OpenMM molecular simulation engine.☆333Jan 7, 2026Updated 6 months ago
- A command line application to launch molecular dynamics simulations with OpenMM☆40Apr 7, 2022Updated 4 years ago
- A free, open-source tool for modeling chemical reaction networks in Python☆13Feb 19, 2026Updated 5 months ago
- ☆19May 27, 2026Updated last month
- Parameter/topology editor and molecular simulator☆451Jul 1, 2026Updated 3 weeks ago
- Python library for advanced atomistic simulations☆23Sep 21, 2017Updated 8 years ago
- An open source Python framework for transition interface and path sampling calculations.☆117Jun 6, 2026Updated last month
- helPME: an efficient library for particle mesh Ewald☆31Feb 28, 2022Updated 4 years ago
- Package to perform minimum-distance distribution analyses of complex solute-solvent interactions☆25Jun 26, 2026Updated 3 weeks 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.
- ☆13Aug 5, 2025Updated 11 months ago
- Endstate corrections from MM to QML potential☆14Feb 28, 2024Updated 2 years ago
- TorchMD-NET. This is a simple code to train Schnet using pytorch-lighthing.☆11Nov 10, 2021Updated 4 years ago
- A general small molecule force field descended from AMBER99 and parm@Frosst, available in the SMIRNOFF format☆31Feb 18, 2026Updated 5 months ago
- general purpose coarse-grained molecular dynamics simulation package☆35Jan 27, 2023Updated 3 years ago
- Python package for automated transition metal complex conformer generation☆24Dec 4, 2025Updated 7 months ago
- ☆48Feb 17, 2026Updated 5 months ago