4:30pm - 5:10pmExploring Electrostatic Effects in Aqueous Nanosystems: From Continuum Models to Classical Force Field Simulations and Machine Learning
P. Loche
EPFL, Switzerland
5:10pm - 5:30pmA L^2 maximum principle on the disk with applications to continuum solvation models
T. Carvalho Corso1, B. Stamm1, A. Jha1, M. Hassan2
1University of Stuttgart; 2EPFL, Switzerland
5:30pm - 5:50pmJulia MolSim: Bridging the Gap between Mathematical Research and Practical Applications in Molecular Simulations
C. Travelletti, M. Herbst
EPFL, Switzerland
5:50pm - 6:10pmComplex Activation and Catalytic Cycles of Deubiquitinylase Enzymes
M. Ilter, M. Stein
Max Planck Institute for Dynamics of Complex Technical Systems, Magdeburg
6:10pm - 6:30pmMolecular dynamics-based investigation of polymer fracture
M. Ries, F. Weber, P. Steinmann, S. Pfaller
FAU Erlangen-Nürnberg
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