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  • University of Stuttgart
  • Stuttgart, Germany

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A high-performance toolkit for atomistic simulations in JAX.

Python 191 9 Updated May 14, 2026

A Rust Implementation of Powell's Dogleg Method for Nonlinear Least Squares

Rust 5 Updated Mar 11, 2026

A modern static site generator by the Material for MkDocs team

Rust 4,637 103 Updated May 16, 2026

These are commands I use with agents, mostly Claude

TypeScript 2,448 179 Updated May 9, 2026

Code for the article "Benchmarking Pretrained Molecular Embedding Models For Molecular Representation Learning" https://arxiv.org/abs/2508.06199

Jupyter Notebook 17 2 Updated Sep 7, 2025
Python 4 Updated Dec 3, 2025

Burn is a next generation tensor library and Deep Learning Framework that doesn't compromise on flexibility, efficiency and portability.

Rust 15,138 906 Updated May 15, 2026

Efficient global optimization toolbox in Rust: bayesian optimization, mixture of gaussian processes, sampling methods

Rust 173 10 Updated May 12, 2026

ORCA Python Interface

Python 161 27 Updated Apr 20, 2026

Open source sigma profile generator.

Jupyter Notebook 13 2 Updated May 6, 2026

Stub file (*.pyi) generator for PyO3

Rust 218 62 Updated May 16, 2026

A powerful expression evaluation crate 🦀.

Rust 407 64 Updated Nov 26, 2025

Turso is an in-process SQL database, compatible with SQLite.

Rust 18,818 946 Updated May 16, 2026

Fast ML inference & training for ONNX models in Rust

Rust 2,261 239 Updated May 14, 2026

Physical quantities in rust

Rust 19 4 Updated May 1, 2026

A reactive notebook for Python — run reproducible experiments, query with SQL, execute as a script, deploy as an app, and version with git. Stored as pure Python. All in a modern, AI-native editor.

Python 21,006 1,092 Updated May 16, 2026

Extremely fast Query Engine for DataFrames, written in Rust

Rust 38,510 2,831 Updated May 15, 2026

A rust fork to work towards Enzyme integration

Rust 92 8 Updated Jun 25, 2025

Magical Rust patterns laid out and simplified

Rust 1,869 55 Updated Aug 15, 2025

Multi-platform high-performance compute language extension for Rust.

Rust 2,143 175 Updated May 15, 2026

Build and publish crates with pyo3, cffi and uniffi bindings as well as rust binaries as python packages

Rust 5,592 404 Updated May 14, 2026

The fastest memoizing and caching Python library written in Rust.

Rust 414 10 Updated Apr 14, 2026

A native Rust library for Delta Lake, with bindings into Python

Rust 3,214 619 Updated May 16, 2026

This is a collection of answers to a SM book Statistical Mechanics Theory and Molecular simulation written by Mark E. Tuckerman. Lecture notes can be added too.

TeX 40 9 Updated May 26, 2016

a Hassle-Free Python Experience

Rust 14,226 472 Updated Feb 5, 2026

integration of the entropy scaling approach into a deep learning architecture to predict viscosities

Jupyter Notebook 3 Updated Apr 29, 2024

Supporting Information: On the continuous modeling of fluid and solid states

Jupyter Notebook 8 1 Updated Dec 19, 2024

Inference at the speed of light.

Rust 2,833 204 Updated May 16, 2026

Code at the speed of thought – Zed is a high-performance, multiplayer code editor from the creators of Atom and Tree-sitter.

Rust 82,993 8,522 Updated May 16, 2026
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