An open library for the analysis of molecular dynamics trajectories

A distributed compute and database platform for quantum chemistry.

Demo notebooks for QCArchive

🍓 Strawberry Music Player

A client interface to the QCArchive Project (read-only image of QCFractal)

Periodic table, physical constants, and molecule parsing for quantum chemistry.

A High-Performance Molecular Quantum Dynamics and Spectroscopy package for general system-bath problems

Arb has been merged into FLINT -- use https://github.com/flintlib/flint/ instead

The C++ Core Guidelines are a set of tried-and-true guidelines, rules, and best practices about coding in C++

Seamless operability between C++11 and Python