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HPMolSim

High Performance Molecular Simulation, or Happy Molecular Simulation

12 followers
China

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README.md

HPMolSim

High Performance Molecular Simluations, or HaPpy Molecular Simulations.

We mainly provided a set of numerical tools for molecular simulations.

Pinned Loading

ExTinyMD.jl ExTinyMD.jl Public

This is a simple MD program.

Julia 9
EwaldSummations.jl EwaldSummations.jl Public

Implementation of standard Ewald2D and Ewald3D methods.

Julia 4
SumOfExpVPMR.jl SumOfExpVPMR.jl Public

An implementation of the VPMR algorithm, approximating decaying kernels by sum of exponentials.

Julia 5 1
SoEwald2D.jl SoEwald2D.jl Public

Sum of Exponentials method accelerated Ewald2D method

Julia 1

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Showing 9 of 9 repositories

ExTinyMD.jl Public
This is a simple MD program.

HPMolSim/ExTinyMD.jl's past year of commit activity

Julia 9 MIT 0 1 0 Updated Sep 15, 2026
FastSpecSoG.jl Public
A fast sum-of-Gaussian algorithm for solving the electrostatic interaction in double periodic systems. Article: https://doi.org/10.1007/s00211-025-01518-y

HPMolSim/FastSpecSoG.jl's past year of commit activity

Julia 3 MIT 0 1 0 Updated Sep 15, 2026
SoEwald2D.jl Public
Sum of Exponentials method accelerated Ewald2D method

HPMolSim/SoEwald2D.jl's past year of commit activity

Julia 1 MIT 0 0 0 Updated Sep 15, 2026
QuasiEwald.jl Public
This is a julia package for Quasi Ewald method.

HPMolSim/QuasiEwald.jl's past year of commit activity

Julia 1 MIT 0 0 0 Updated Sep 15, 2026
SumOfExpVPMR.jl Public
An implementation of the VPMR algorithm, approximating decaying kernels by sum of exponentials.

HPMolSim/SumOfExpVPMR.jl's past year of commit activity

Julia 5 MIT 1 1 1 Updated Sep 1, 2025
EwaldSummations.jl Public
Implementation of standard Ewald2D and Ewald3D methods.

HPMolSim/EwaldSummations.jl's past year of commit activity

Julia 4 MIT 0 2 0 Updated May 2, 2025
ChebParticleMesh.jl Public
Using Chebyshev polynomials to interpolate/gather particles onto mesh grids.

HPMolSim/ChebParticleMesh.jl's past year of commit activity

Julia 2 MIT 0 0 0 Updated Dec 18, 2024
BoundaryElementSolver.jl Public
A solver for the boundary element method.

HPMolSim/BoundaryElementSolver.jl's past year of commit activity

Julia 0 MIT 1 0 1 Updated Nov 18, 2024
.github Public

HPMolSim/.github's past year of commit activity

0 0 0 0 Updated Jan 7, 2024

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