An extremely fast Python type checker and language server, written in Rust.

Ray is an AI compute engine. Ray consists of a core distributed runtime and a set of AI Libraries for accelerating ML workloads.

Library for animated data visualizations and data stories.

A repo for demo at PyData NYC 2022

API and CLI for ECAM-based Delonghi machines

Python logging made (stupidly) simple

Practical Cheminformatics Tutorials

🦉 Data Versioning and ML Experiments

A PyTorch and TorchDrug based deep learning library for drug pair scoring. (KDD 2022)

A proof-of-concept jupyter extension which converts english queries into relevant python code

The official sources for the RDKit library

Official electron build of draw.io

An open-source, low-code machine learning library in Python

MDAnalysis home page mdanalysis.org as GitHub pages.

Jupyter widget to interactively view molecular structures and trajectories

The fundamental package for scientific computing with Python.

AI-related tutorials. Access any of them for free → https://towardsai.net/editorial

INSert membrANE - A simple, versatile tool for building coarse-grained simulation systems

Kalos embeddable scripting language

A comprehensive tool for analyzing liquid solvation structure.

Vector-geometry toolbelt for 3D points and vectors

Easy and fast file sharing from the command-line.