Ecosyste.ms: Packages

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conda-forge.org : mpiplus

Mpiplus is a GPU-accelerated Python framework for exploring algorithms for alchemical free energy calculations

Registry - Source - Homepage - JSON
purl: pkg:conda/mpiplus
Keywords: mpi, openmm, openmmtools, python, yank
License: MIT
Latest release: over 5 years ago
First release: over 5 years ago
Dependent packages: 2
Dependent repositories: 2
Stars: 3 on GitHub
Forks: 1 on GitHub
See more repository details: repos.ecosyste.ms
Last synced: 17 days ago

openmmtools 0.21.5

openmmtools is a Python library layer that sits on top of OpenMM to provide access to a variety o...
10 versions - Latest release: almost 2 years ago - 9 dependent packages - 15 dependent repositories - 166 stars on GitHub

yank 0.25.2

YANK is a testbed for experimenting with algorithms for the efficient computation of small molecu...
1 version - Latest release: over 3 years ago - 2 dependent packages - 1 dependent repositories - 149 stars on GitHub