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Search results for python hpc

190 search results found

Spack ⭐ 4,652

A flexible package manager that supports multiple versions, configurations, platforms, and compilers.

Scientific Python Lectures ⭐ 3,372

Lectures on scientific computing with python, as IPython notebooks.

Udocker ⭐ 1,155

A basic user tool to execute simple docker containers in batch or interactive systems without root privileges.

Pythonidae ⭐ 810

Curated decibans of scientific programming resources in Python.

Covalent ⭐ 608

Pythonic tool for running machine-learning/high performance/quantum-computing workflows in heterogeneous environments.

Pyslurm ⭐ 502

Python Interface to Slurm

Backend.ai ⭐ 449

Backend.AI is a streamlined, container-based computing cluster platform that hosts popular computing/ML frameworks and diverse programming languages, with pluggable heterogeneous accelerator support including CUDA GPU, ROCm GPU, TPU, IPU and other NPUs.

Easybuild ⭐ 428

EasyBuild - building software with ease

Hpc Container Maker ⭐ 419

HPC Container Maker

Parallel programming with Python

Kernels ⭐ 386

This is a set of simple programs that can be used to explore the features of a parallel platform.

A probabilistic programming system for simulators and high-performance computing (HPC), based on PyTorch

VisIt - Visualization and Data Analysis for Mesh-based Scientific Data

Oq Engine ⭐ 345

OpenQuake's Engine for Seismic Hazard and Risk Analysis

Elasticluster ⭐ 334

Create clusters of VMs on the cloud and configure them with Ansible.

Easybuild Easyconfigs ⭐ 318

A collection of easyconfig files that describe which software to build using which build options with EasyBuild.

Charm4py ⭐ 280

Parallel Programming with Python and Charm++

Batch Shipyard ⭐ 270

Simplify HPC and Batch workloads on Azure

Open Source Architecture Code Analyzer

Deephyper ⭐ 253

DeepHyper: Scalable Asynchronous Neural Architecture and Hyperparameter Search for Deep Neural Networks

Arkouda ⭐ 215

Arkouda (αρκούδα): Interactive Data Analytics at Supercomputing Scale 🐻

quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.

Jaxfluids ⭐ 203

Differentiable Fluid Dynamics Package

Smartsim ⭐ 196

SmartSim Infrastructure Library.

Batchspawner ⭐ 167

Custom Spawner for Jupyterhub to start servers in batch scheduled systems

Underworld2 ⭐ 143

underworld2: A parallel, particle-in-cell, finite element code for Geodynamics.

Easybuild Framework ⭐ 138

EasyBuild is a software installation framework in Python that allows you to install software in a structured and robust way.

Bssw.io ⭐ 130

Better Scientific Software Homepage

Maestrowf ⭐ 122

A tool to easily orchestrate general computational workflows both locally and on supercomputers

Training Material ⭐ 114

A collection of code examples as well as presentations for training purposes

Python client for OmniSci GPU-accelerated SQL engine and analytics platform

Machine Learning for HPC Workflows

[Historical] Reproducible Analyses for Bioinformatics

Flashbax ⭐ 100

⚡ Flashbax: Accelerated Replay Buffers in JAX

Easybuild Easyblocks ⭐ 93

Collection of easyblocks that implement support for building and installing software with EasyBuild.

OpenDILab RL HPC OP Lib

Docker Centos7 Slurm ⭐ 81

Slurm Docker Container on CentOS 7

Coldfront ⭐ 79

HPC Resource Allocation System

Course material on scientific software development for researchers in earth and planetary surface processes

Execute a subset of Python on HPC platforms

Wrapspawner ⭐ 56

Mechanism for runtime configuration of spawners for JupyterHub

Radical.pilot ⭐ 52

Mpi Sppy ⭐ 48

MPI-based Stochastic Programming in PYthon

Production ⭐ 47

General interest repository for CSCS users

Aws Batch Runtime Monitoring ⭐ 46

Serverless application to monitor an AWS Batch architecture through dashboards.

Cyclecloud Slurm ⭐ 45

Azure CycleCloud project to enable users to create, configure, and use Slurm HPC clusters.

Is This a Joke? Humor Detection in Spanish Tweets

Waldur Mastermind ⭐ 42

Waldur MasterMind is a hybrid cloud orchestrator.

The Distributed Computing library for python implemented using PyCOMPSs programming model for HPC.

Gisola: A High Performance Computing application for real-time Moment Tensor inversion

Pavilion2 ⭐ 39

Pavilion is a Python 3 (3.5+) based framework for running and analyzing tests targeting HPC systems.

COMP Superscalar (COMPSs) is a framework which aims to ease the development and execution of applications for distributed infrastructures, such as Clusters, Grids and Clouds.

Python_hpc_tutorial ⭐ 37

Easy SimAuto (ESA): An easy-to-use Power System Analysis Automation Environment atop PowerWorld Simulator Automation Server (SimAuto)

TriBITS: Tribal Build, Integrate, and Test System,

Preforms De novo protein design using machine learning and PyRosetta to generate a novel protein structure

Hpc Novice ⭐ 31

Novice introduction to high performance computing

Repast4py ⭐ 31

Git repository for Repast for Python development

🪐 The Sebulba architecture to scale reinforcement learning on Cloud TPUs in JAX

A versatile, template-based FORTRAN wrapper written in Python.

Rcworkshops ⭐ 29

ASU Research Computing :: materials from hosted workshops

Imperialmscaiutils ⭐ 29

A repo containing useful things for the MSc AI course at Imperial

Examplejobs ⭐ 28

Example job submission and application scripts for Northwestern's Quest computing cluster

Callflow ⭐ 26

Visualization tool for analyzing call trees and graphs

Covalent Slurm Plugin ⭐ 26

Executor plugin interfacing Covalent with Slurm

A REST API for creating and using cloud clusters

Automatically take good care of your preemptible TPUs

Python For Hpc ⭐ 25

Repository for participants of the "Python for HPC" training

Numba Mpi ⭐ 24

Numba @njittable wrappers for MPI C API tested on Linux, macOS and Windows

Qhub Hpc ⭐ 22

Firecrest ⭐ 22

Hpchadoop ⭐ 22

Hadoop for Traditional HPC Users

Extra-P, automated performance modeling for HPC applications

This pipeline is executing a RE-EDS run for relative free energy calculations. It can be used for example for calculation of hydration free energies or ligand binding free energies.

Benchpark ⭐ 21

An open collaborative repository for reproducible specifications of HPC benchmarks and cross site benchmarking environments

Es_pytorch ⭐ 20

High performance implementation of Deep neuroevolution in pytorch using mpi4py. Intended for use on HPC clusters

Kaleidoscope Sdk ⭐ 20

A user toolkit for analyzing and interfacing with Large Language Models (LLMs)

Implementation of the FV3GFS / SHiELD atmospheric model in Python

Python Mpi Bcast ⭐ 20

python start-up, in a HPC friendly manner

Twingraph ⭐ 19

TwinGraph is a Python framework for distributed container orchestration using Kubernetes clusters, Docker Compose/Swarm or cloud resources on AWS (AWS Lambda, AWS Batch, Amazon EKS). Applications include high-throughput simulations, simulation-driven optimization, Digital Twins and machine learning.

Pararealml ⭐ 19

A machine learning boosted parallel-in-time differential equation solver framework.

Freely programmable source-to-source translation for Fortran

Jaxdecomp ⭐ 18

JAX bindings for the NVIDIA cuDecomp library

Aws Rosettafold ⭐ 18

Infrastructure template and Jupyter notebooks for running RoseTTAFold on AWS Batch.

Run Python functions locally or in the cloud. Built for computational science.

Alphafold_singularity ⭐ 17

Singularity recipe for AlphaFold

Hpccloud Deploy ⭐ 17

VM Deploy for HPC-Cloud

Aws Decoupled Serverless Scheduler ⭐ 16

AWS Decoupled Serverless Scheduler

Adaptivemd ⭐ 16

A python framework to run adaptive Markov state model (MSM) simulation on HPC resources

High Performance Computing Cluster Engineering Academy within Livermore Computing

Parallelclustermaker ⭐ 15

ParallelClusterMaker is a command line toolkit for automating the creation and destruction of AWS ParallelCluster stacks.

Smartsim Zoo ⭐ 14

A repository of CrayLabs and user contributed examples of using SmartSim.

Workflow for identifying and classifying homologous gene/protein sequences

Upsp Processing ⭐ 14

Software for processing high-speed video recordings from Unsteady Pressure-Sensitive Paint (UPSP) measurement systems. https://nasa.github.io/upsp-processing

Toolchest Client Python ⭐ 13

Toolchest Python client

Slurmtools ⭐ 13

Custom Slurm tools

Hanythingondemand ⭐ 13

hanythingondemand provides a set of scripts to easily set up an ad-hoc Hadoop cluster through PBS jobs

Simple HPC queuing system adapter for Python on based jinja templates to automate the submission script creation.

Aiida Fleur ⭐ 13

Package containing the AiiDA-FLEUR plugin(s) and some workflows for the FLEUR program (www.flapw.de) implementing DFT methods. This is a JuDFT effort see (www.judft.de).

Hpc Examples ⭐ 13

Examples of Triton usage

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