- Molecular Simulations
- Neurobiology
- Drug Design
- +۴ مورد دیگر
Prof. Paolo Carloni is Director of the Computational Biomedicine group (INM-9) at the Institute of Neuroscience and Medicine (INM), Research Center Jülich. He holds a Professorship and has over 30 years of expertise in developing multiscale molecular simulation methods to study biomolecular systems. His research focuses on structure-function relationships of enzymes, neuroreceptors, and drug resistance mechanisms, leveraging high performance computing and machine learning. Research Interests: Multiscale simulation techniques (quantum to coarse-grained) Neurobiological processes and signaling cascades Drug design targeting neuroreceptors and RNA-binding proteins Metadynamics and free-energy calculations Exascale computing for biomolecular applications Recent Work: His publications emphasize computational drug discovery, ligand-receptor interactions, and understanding protein mutations linked to neurodegenerative diseases. He leads projects on exascale algorithm optimization and FAIR data principles in simulations. Awards: While no specific awards are listed, his Google Scholar h-index of 67 reflects significant academic impact. Lab & Collaborations: Active in the INM-9 lab, collaborating with Jülich Supercomputing Centre (JSC) and Helmholtz Association initiatives. His team focuses on computational tools like MiMiC and QM/MM simulations.






