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High Performance Computing Python Packages

Python packages with the GitHub topic high-performance-computing. Sorted by relevance, with stars and monthly downloads.
Netflix
metaflow

Build, Manage and Deploy AI/ML Systems

696K 10K 1K
Netflix
metaflow-stubs

Build, Manage and Deploy AI/ML Systems

59K 10K 1K
LibRapid
librapid

A highly optimised C++ library for mathematical applications and neural networks.

58K 180 10
neuronsimulator
neuron

NEURON Simulator

47K 516 142
exaxorg
accelerator

The Accelerator is a tool for fast and reproducible processing of eBay-scale datasets on a single computer.

36K 4 2
mushroomfire
mdapy

A simple and fast python library to handle the data generated from molecular dynamics simulations

25K 98 13
cryoem-uoft
cryosparc-tools

Python library that enables scripting access to CryoSPARC, a cryo-EM software package.

24K 47 10
google
tff-nightly

High-performance TensorFlow library for quantitative finance.

22K 5K 679
okkevaneck
prospr

Prospr is a universal toolbox for protein structure prediction within the HP-model. The Python package is based on a C++ core, which gives Prospr its high performance. The C++ core is made available as a separate zip file to facilitate high-performance computing applications. The package comes with many prediction algorithms and datasets to use.

21K 17 1
neuronsimulator
neuron-nightly

NEURON Simulator

21K 516 142
sail-sg
envpool

C++-based high-performance parallel environment execution engine (vectorized env) for general RL environments.

16K 1K 133
neutrinoceros
rlic

A minimal Line Integral Convolution extension for NumPy, written in Rust

9K 6 1
ornladios
adios2

Next generation of ADIOS developed in the Exascale Computing Program

9K 319 148
stfc
psyclone

PSyclone is a source-to-source Fortran compiler designed to programmatically optimise, parallelise and instrument HPC applications via user-provided transformation scripts.

8K 132 33
kahypar
mtkahypar

Mt-KaHyPar (Multi-Threaded Karlsruhe Hypergraph Partitioner) is a shared-memory multilevel graph and hypergraph partitioner equipped with parallel implementations of techniques used in the best sequential partitioning algorithms. Mt-KaHyPar can partition extremely large hypergraphs very fast and with high quality.

6K 180 37
spcl
dace

DaCe - Data Centric Parallel Programming

6K 581 155
fluiddyn
fluidsim

:ocean: Framework for studying fluid dynamics with numerical simulations using Python (publish-only mirror). The main repo is hosted on https://foss.heptapod.net (Gitlab fork supporting Mercurial).

5K 73 12
NL-BioImaging
biomero

BIOMERO.analyzer - A python library for easy connecting between OMERO (jobs) and a Slurm cluster

5K 28 6
keichi
kedm

A high-performance implementation of Empirical Dynamic Modeling (EDM)

4K 20 5
robbert-harms
mot

Multi-threaded Optimization Toolbox

3K 32 10
flecsi
flecsi-sandbox

Flexible Computational Science (FleCSI) Project

3K 26 15
helmholtz-analytics
heat

Distributed tensors and Machine Learning framework with GPU and MPI acceleration in Python

2K 238 65
mpi4jax
mpi4jax

Zero-copy MPI communication of JAX arrays, for turbo-charged HPC applications in Python ⚡

2K 524 32
esa
torchquad

Numerical integration in arbitrary dimensions on the GPU using PyTorch / TF / JAX

2K 224 44
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