HadrienNU
I am a postdoc at Institut des Sciences du calcul et des Données at Sorbonne Université.
Paris, France
Pinned Repositories
better_kan
A mix of efficient-kan and pykan including plotting and pruning
BSplineKit.jl
A collection of B-spline tools in Julia
DiffEqDevTools.jl
Benchmarking, testing, and development tools for differential equations and scientific machine learning (SciML)
DiffEqDocs.jl
Documentation for the DiffEq differential equations and scientific machine learning (SciML) ecosystem
dscribe
DScribe is a python package for creating machine learning descriptors for atomistic systems.
GLE_AnalysisEM
Statistical inference of Generalized Langevin Equation using Expectation-Maximization algorithm
LangevinIntegrators.jl
A set of integrators for the Langevin equation.
molecular-dynamics
Simple Molecular Dynamics simulation scripts, calculating Lennard-Jones potential and integrating the forces of motion in 1D and 3D.
VolterraBasis
Python 3 tool suite for the computation of position dependent memory kernels from time series.
HadrienNU's Repositories
HadrienNU/better_kan
A mix of efficient-kan and pykan including plotting and pruning
HadrienNU/GLE_AnalysisEM
Statistical inference of Generalized Langevin Equation using Expectation-Maximization algorithm
HadrienNU/VolterraBasis
Python 3 tool suite for the computation of position dependent memory kernels from time series.
HadrienNU/LangevinIntegrators.jl
A set of integrators for the Langevin equation.
HadrienNU/molecular-dynamics
Simple Molecular Dynamics simulation scripts, calculating Lennard-Jones potential and integrating the forces of motion in 1D and 3D.
HadrienNU/BSplineKit.jl
A collection of B-spline tools in Julia
HadrienNU/DiffEqDevTools.jl
Benchmarking, testing, and development tools for differential equations and scientific machine learning (SciML)
HadrienNU/DiffEqDocs.jl
Documentation for the DiffEq differential equations and scientific machine learning (SciML) ecosystem
HadrienNU/dscribe
DScribe is a python package for creating machine learning descriptors for atomistic systems.
HadrienNU/floppyMD
Tentative start for floppyMD
HadrienNU/KrylovKit.jl
Krylov methods for linear problems, eigenvalues, singular values and matrix functions
HadrienNU/mdanalysis
MDAnalysis is a Python library to analyze molecular dynamics simulations.
HadrienNU/scikit-fem
Simple finite element assemblers
HadrienNU/mlcolvar
A unified framework for machine learning collective variables for enhanced sampling simulations
HadrienNU/optimesh
:spider_web: Mesh optimization, mesh smoothing.
HadrienNU/pysisyphus
Python suite for optimization of stationary points on ground- and excited states PES and determination of reaction paths.
HadrienNU/SciMLBase.jl
The Base interface of the SciML ecosystem
HadrienNU/StochasticDiffEq.jl
Solvers for stochastic differential equations which connect with the scientific machine learning (SciML) ecosystem