Awesome Open Source
Search
Programming Languages
Languages
All Categories
Categories
About

Ensemble_md

A python package for performing GROMACS simulation ensembles
Stars
9
License
mit
Open Issues
4
Most Recent Commit
6 months ago
Programming Language
Python
Total Releases
5
Latest Release
October 25, 2023
Categories
Repo
Alternatives To Ensemble_md
Project NameStarsDownloadsRepos Using ThisPackages Using ThisMost Recent CommitTotal ReleasesLatest ReleaseOpen IssuesLicenseLanguage
Enspara32
7 months ago135May 17, 202029gpl-3.0Python
Modeling molecular ensembles with scalable data structures and parallel computing
Rxmd18
9 months ago22gpl-3.0Fortran
RXMD : Linear-Scaling Parallel Reactive Molecular Dynamics Simulation Engine
Qxmd10
9 months agogpl-3.0Fortran
QXMD: Non-adiabatic Quantum Molecular Dynamics Simulation Engine
Ensemble_md9
6 months ago5October 25, 20234mitPython
A python package for performing GROMACS simulation ensembles
Alternatives To Ensemble_md
Select To Compare


Suggest An Alternative To ensemble_md
Alternative Project Comparisons
Ensemble_md vs Enspara
Ensemble_md vs Rxmd
Ensemble_md vs Qxmd
Popular Parallel Computing Projects
Taskflow ⭐ 9,588
A General-purpose Parallel and Heterogeneous Task Programming System
total releases 6latest release May 24, 2022most recent commit a day ago
Joblib ⭐ 3,543
Computing with Python functions.
dependent packages 3,208total releases 110latest release August 09, 2023most recent commit 4 months agopypi joblib} Downloads
Ctranslate2 ⭐ 2,437
Fast inference engine for Transformer models
dependent packages 23total releases 103latest release December 05, 2023most recent commit 4 months agopypi ctranslate2} Downloads
Popular Molecular Dynamics Projects
Lammps ⭐ 1,944
Public development project of the LAMMPS MD software package
dependent packages 1total releases 10latest release October 13, 2022most recent commit 4 months ago
Openmm ⭐ 1,351
OpenMM is a toolkit for molecular simulation using high performance GPU code.
dependent packages 24total releases 4latest release March 02, 2022most recent commit a month ago
Deepmd Kit ⭐ 1,303
A deep learning package for many-body potential energy representation and molecular dynamics
dependent packages 2total releases 44latest release October 27, 2023most recent commit 4 months agopypi deepmd-kit} Downloads
Mdanalysis ⭐ 1,154
MDAnalysis is a Python library to analyze molecular dynamics simulations.
dependent packages 111total releases 48latest release December 02, 2023most recent commit 4 months agopypi MDAnalysis} Downloads
Popular Control Flow Categories
Stream
Thread
Promise
Series
Webhook
Daemon
Parallel
Reactive
Rxjava
Cron
Related Searches
Python Molecular Dynamics
Python Parallel Computing
Python Statistical Mechanics
Python Free Energy Calculations
Molecular Dynamics Statistical Mechanics
Parallel Computing Molecular Dynamics
Molecular Dynamics Free Energy Calculations
Python Replica Exchange
Free Energy Calculations Replica Exchange

Get A Weekly Email With Trending Projects For These Categories
No Spam. Unsubscribe easily at any time.
Python
Parallel Computing
Molecular Dynamics
Privacy | About | Terms | Follow Us On Twitter

Downloads, Dependent Repos, Dependent Packages, Total Releases, Latest Releases data powered by Libraries.io.

Copyright 2018-2024 Awesome Open Source.  All rights reserved.