2022 Annual Meeting

Session: Thermodynamics of Biomolecular Folding and Assembly

Chair

Zerze, G. H., Princeton University

Co-Chair

Shukla, D., University of Illinois At Urbana-Champaign

Presentations

12:30 PM

(712a) Critical Evaluation of Implicit Solvent Hydration Free Energies from EEF1, Absinth, and GB/SA Versus Explicit Solvent Molecular-QCT Calculations

12:45 PM

(712b) Physics-Based Modeling of Chromosomal Organization Impacted By Multiple Epigenetic Factors

01:00 PM

(712d) Protein-Polyelectrolyte Assembly: Influence on Structural Stability

01:15 PM

(712e) Simulating Self-Assembly of Key Fragments on the ?-Synuclein N-Terminal Using Discontinuous Molecular Dynamics Simulations

01:30 PM

(712f) How Does Foldamer Side Chain Entropy Affect Folding Cooperativity?

01:45 PM

(712g) The Transition State for the Growth of the Three-Fold Polymorph of Amyloid-? Fibrils Is Supported By Native Contacts

02:00 PM

(712h) Identifying Key Interactions in Amylin Self-Assembly Via Discontinuous Molecular Dynamics

02:15 PM

(712i) String Method Based Free Energy Calculations Reveal the Role of Membrane Cholesterol in Bacterial Toxin Activity

02:30 PM

(712j) Graph Network Analysis of Protein-Osmolyte Preferential Interactions