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.

9 of 5,923 resources

An interactive structure/property explorer for materials and molecules.

Active1782 days ago
TypeScript
BSD-3-Clause

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 package for working with nuclear magnetic resonance (NMR) data including functions for reading common binary file formats and processing NMR data.

Active2654 months ago
Python
BSD-3-Clause

A module for solving and visualizing the Schrödinger equation.

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

A Deep Learning Library for Compound and Protein Modeling DTI, Drug Property, PPI, DDI, Protein Function Prediction.

Stale1.2K2 years ago
Jupyter Notebook
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

Graph Networks as a Universal Machine Learning Framework for Molecules and Crystals.

Archived5563 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

Jupyter Widgets to interact with molecular datasets.

Stale333 years ago
CSS
BSD-3-Clause