Browsing Chemistry & Biochemistry Theses and Dissertations by Author "Ballard, Andrew James"

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    • Exploring Equilibrium Systems with Nonequilibrium Simulations 

      Ballard, Andrew James (2012)
      Equilibrium sampling is at the core of computational thermodynamics, aiding our understanding of various phenomena in the natural sciences including phase coexistence, molecular solvation, and protein folding. Despite the ...