Find open-source science resources

A directory of tools, AI models, datasets, and research resources for biotech, bioinformatics, and other scientific fields. Aggregated from curated GitHub awesome-lists, HuggingFace, bio.tools, Bioconductor, and more.

4 of 5,893 resources

A library containing basis sets for use in quantum chemistry calculations. In addition, this library has functionality for manipulation of basis set data.

Active1993 months ago
Python
BSD-3-Clause

A module for solving and visualizing the Schrödinger equation.

Idle1.2K1 year ago
Python
BSD-3-Clause

Psi4-based reference implementations and Jupyter notebook-based tutorials for foundational quantum chemistry methods.

Stale3942 years ago
Jupyter Notebook
BSD-3-Clause

Open Drug Discovery Toolkit, a modular and comprehensive toolkit for use in cheminformatics, molecular modeling etc.

Stale4643 years ago
Python
BSD-3-Clause