Dr. U Deva Priyakumar gave a talk on Machine Learning for DFT Quality Energies and for Analysing Biomolecular Trajectories at the Advanced Simulation Methods: DFT, MD and Beyond ASM (2019) at IIT Delhi from 6 – 10 March.
His student Tanashree Jaganade made an oral presentation of their work on Unraveling the dynamics and energetic events involved in flipping process of Thymine Glycol lesion.
ASM2019 is a first-of-its-kind event dedicated to advanced computational methods such as Density Functional Theory (DFT), Molecular Dynamics (MD) simulation techniques and their applications to solve various multiscale and multidisciplinary research problems. The event brought together researchers and scientists working in various computational methods to exchange ideas in state-of-the-art methods in electronic and atomic structure.