volkamerlab/teachopencadd

Practical Cheminformatics Tutorials

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

List of Molecular and Material design using Generative AI and Deep Learning

The official sources for the RDKit library

Cloud-based molecular simulations for everyone

BioNeMo Recipes: For building and adapting AI models in drug discovery at scale

Message Passing Neural Networks for Molecule Property Prediction

Open Drug Discovery Toolkit

FAIR Chemistry's library of machine learning methods for chemistry