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Cascella-Group-UiO

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HyMD HyMD Public

Massively parallel hybrid particle-field molecular dynamics in Python.

Python 23 7
Publications Publications Public

This repository contains links to the publications and to the corresponding archives of simulation data.

1 1

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All C++ Jupyter Notebook Python

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Showing 6 of 6 repositories

Publications Public
This repository contains links to the publications and to the corresponding archives of simulation data.

1 1 0 0 Updated Mar 26, 2024
Diff-HyMD Public
Differentiable particle-field molecular dynamics in JAX

Python 5 LGPL-3.0 0 0 0 Updated Mar 25, 2024
gmx2HyMD Public
Conversion utility for HyMD

Python 2 LGPL-3.0 0 0 0 Updated Mar 25, 2024
HyMD Public
Massively parallel hybrid particle-field molecular dynamics in Python.

Python 23 LGPL-3.0 7 27 (1 issue needs help) 1 Updated Oct 6, 2023
plumed-sans Public Forked from plumed/plumed2
Fork of plumed 2 containing the implementation of SANS with resolution function.

C++ 0 LGPL-3.0 267 0 0 Updated May 11, 2023
HyMD-tutorial Public
Tutorial examples for HylleraasMD

Jupyter Notebook 5 GPL-3.0 0 0 0 Updated Dec 21, 2021

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