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  1. 1. My Research Faidon Brotzakis Computational chemistry PhD candidate - UvA
  2. 2. Backround • Graduate studies at Chemical engineering department NTUA athens • Thesis: “Study of the dynamic relaxation of atactic polystyrene using MD and rare event methods.” Supervisor: Doros Theodorou
  3. 3. Water dynamics around folded and misfolded proteins Anisotropy decay experiments
  4. 4. Structure and water dynamics around anti- freeze protein III
  5. 5. Self Assembly of Anti Freeze Cyclic Peptides into Nanotubes
  6. 6. β-lactoglobulin globular protein dimer association • Transition Path sampling of rare event dimer association transition: -Mechanism