atzkenneth

Kenneth Atz's repositories

De novo drug design with deep interactome learning

Language:PythonAGPL-3.016 2 6

Enabling late-stage drug diversification by high-throughput experimentation with geometric deep learning

Language:PythonMIT4 10

Identifying opportunities for late-stage C-H alkylation with in silico reaction screening and high-throughput experimentation

Language:PythonAGPL-3.03 10

Exploring protein-ligand binding affinity prediction with electron density-based geometric deep learning

Language:PythonMIT000

Δ-QML for medicinal chemistry

Language:PythonAGPL-3.0000

Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes

Language:JavaScriptMIT010