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computational-science · GitHub Topics · GitHub

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computational-science

Here are 265 public repositories matching this topic...

Lecture Notes for Linear Algebra Featuring Python. This series of lecture notes will walk you through all the must-know concepts that set the foundation of data science or advanced quantitative skillsets. Suitable for statistician/econometrician, quantitative analysts, data scientists and etc. to quickly refresh the linear algebra with the assis…

  • Updated Sep 5, 2024
  • Jupyter Notebook

Lightweight, general, scalable C++ library for finite element methods

  • Updated Aug 28, 2026
  • C++

SimTK OpenSim C++ libraries and command-line applications, and Java/Python wrapping.

  • Updated Aug 28, 2026
  • C++

The ReScience journal. Reproducible Science is Good. Replicated Science is better.

  • Updated Jul 25, 2022

PyTensor allows you to define, optimize, and efficiently evaluate mathematical expressions involving multi-dimensional arrays.

  • Updated Aug 28, 2026
  • Python

An open-source, web-native notebook interface for Wolfram Language / Wolfram Engine

  • Updated Aug 27, 2026
  • Wolfram Language

The official repository for the AiiDA code

  • Updated Aug 27, 2026
  • Python

ReproZip is a tool that simplifies the process of creating reproducible experiments from command-line executions, a frequently-used common denominator in computational science.

  • Updated Feb 4, 2026
  • Python

Lightweight OpenGL tool for accurate and flexible finite element visualization

  • Updated Aug 18, 2026
  • C++

Composable computational-science methodology skills for AI research agents — pre-registration over TDD. A science-domain reimplementation of Superpowers.

  • Updated Aug 18, 2026
  • Shell

A Python library which allows construction and manipulation of complex molecules, as well as automatic molecular design and the creation of molecular databases.

  • Updated Jan 4, 2026
  • Python

Log shell-commands and used files. Snapshot executed scripts. Fully automatic.

  • Updated Apr 10, 2025
  • C++

awesome open list of pointers about open science for software and computational science

  • Updated Aug 25, 2026

A publicly-editable collection of open science resources, including tools, datasets, meta-resources, etc.

  • Updated Aug 12, 2022

Electron/X-ray ptychography and tomography/laminography

  • Updated Nov 23, 2024
  • MATLAB

Crack Analysis Tool in Python (CrackPy) - automatic detection and fracture mechanical analysis of (fatigue) cracks using digital image correlation

  • Updated Nov 25, 2025
  • Python

"Introduction to Python" course for future MSc students at Ada Lovelace Academy, Imperial College London

  • Updated Aug 13, 2026
  • Jupyter Notebook

Main repository for sharing files and documents about OpenDreamKit

  • Updated Oct 9, 2020
  • TeX

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