EXTENDING THE CENTRAL DOGMA: DEVELOPING NOVEL INFORMATIONAL BIOPOLYMERS

Ab initio Molecular Potential Energy Surface Constructionand Molecular Dynamics Simulation for Small Molecules

Changes in State: Simulations of Aggregation and Ordering in Finite Systems

Simulation of Membrane Proteins and Lipids: Dynamic Behavior of a Small Antimicrobial Peptide

Potential energy surface and applications to carbon dioxide-water, carbon dioxide clathrate hydrate and hydrated HCl system