Biophysical Society Thematic Meeting | Hamburg 2022

Biophysics at the Dawn of Exascale Computers

Daily Schedule

14:15 – 14:45

Nathalie Reuter, University of Bergen, Norway Deciphering the Energetics of Peripheral Protein-Membrane Interactions Luise Jacobsen, University of Southern Denmark, Denmark* Introducing the Automated: Ligand Searcher (Alise) An Ghysels, Ghent University* Pushing the Time Scale of Membrane Permeability Calculations Macromolecular Interactions III (Confined Environments) Abhishek Singharoy, Arizona State University, USA, Chair Helmut Grubmüller, Max Planck Institute, Germany Single Molecular Structure and Function at the Dawn of Exascale Computers Emad Tajkhorshid, University of Illinois at Urbana-Champaign, USA Novel Modeling Tools and Simulation Approaches for Exascale Structural Biology Kush Coshic, University of Illinois at Urbana-Champaign, USA* The Structure and Physical Properties of a Bacteriophage Genome Resolved Through Atomistic Molecular Dynamics Simulation Coffee Break / Poster Session III

14:45 – 15:00

15:00 – 15:15

15:15 – 17:00

Foyer

Session X 17:00 – 17:15

17:15 – 17:45

17:45 – 18:15

18:15 – 18:30

18:30 – 18:45

Benedikt Rennekamp, Heidelberg University, Germany* Hybrid Simulations of Collagen Failure

Banquet

20:00 – 23:00

Fischclub Blankenese

Friday, May 20, 2022 08:30 – 15:45

Information

Foyer

Session XI 09:00 – 09:15

Protein Folding and Assembly III (Supercomplexes and Beyond) Raimund Fromme, Arizona State University, USA, Chair JC Gumbart, Georgia Tech, USA Combatting Microbial Infections with Leadership-Class MD Simulations Ulrich Kleinekathöfer, Jacobs University Bremen, Germany* Insight from Advanced Molecular Simulation Approaches into Transport Across Bacterial Membranes Ryan Cheng, Rice University, USA A Physicochemical Basis for Chromosome Organization and Structural Heterogeneity Across Human Cell Types

09:15 – 09:45

09:45 – 10:15

10:15 – 10:45

Coffee Break

10:45 – 11:15

Foyer

Session XII 11:15 – 11:30

DNA, Nucleosomes, and Chromatin

Rosana Collepardo, University of Cambridge, United Kingdom, Chair

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