Multiscale modeling of Magnetization Dynamics
Automated and scalable predictive modeling in drug discovery with cloud computing, micro-services and Big Data frameworks
Grid research
Computational Design Optimization and Inverse Problems for Wave Propagation Problems
A unified theory of the rare-earth elements
Non-adiabatic chemical processes: chemistry beyond the Born–Oppenheimer approximation
Virtual Chemsitry
A multiscale modelling platform for Materials Chemistry