Dr Vigneshwari Subramanian
(based in AstraZeneca in Sweden)
Accurate Permeability Prediction for New Modalities
Using Molecular Dynamics simulations to understand chocolate behaviour
Towards First-Principles Calculation of Physicochemical Properties in Pharmaceutical Drug Discovery
Alexander van Teijlingen
Reducing peptide self-assembly search space via active machine learning of sample space.
Murphy and Tuttle labs
Elucidation of radical and single electron transfer mechanism via DFT
Probing protein structure, dynamics and interactions using biophysical, structural and computational approaches.
Artificial Intelligence in Computational Drug Discovery