Bioquímica Farmacológica — Computational Lab
Computational lab materials on structure-based drug design: a GNINA docking workshop and a docking-simulation notebook, working with a real receptor-inhibitor pair (acetylcholinesterase).
Aurelio Moya García
My research asks whether protein language models implicitly encode the physics of allosteric communication, connecting structural bioinformatics, systems pharmacology and information theory. Former Marie Curie Fellow at University College London; I teach Biochemistry and Biophysics at Universidad de Málaga.