This review deals with dynamics of water molecules in the hydration layer that surrounds
selfassemblies and proteins in aqueous solutions. This topic has not only seen a vigorous …

Many hydrogen-bonded liquids, molecular solids, and lowdimensional systems support
anomalous diffusion mechanisms of topological charge defects created by the addition or …

The surface tension of water is an important parameter for many biological or industrial
processes, and roughly a factor of 3 higher than that of nonpolar liquids such as oils, which …

Water molecules confined in a supramolecular assembly control reactivity and dynamics of
biological systems in a unique way. In a confined system, water molecules display an …

We have carried out first-principles Born–Oppenheimer molecular dynamics (BOMD)
simulations of heavy water using density functional theory in conjunction with either …

The invention and development of laser technology and other related ultrafast techniques
has opened and established new areas in molecular science called femtochemistry and …

Micelles are prevalent in naturally occurring and biological catalytic reactions. However, it is
only in recent decades that scientists have developed kinetic models clarifying how micelle …

We report a molecular dynamics study of the structure and dynamics of water at a clay
surface. The negative charge of the surface and the presence of surface oxygen atoms …

Historical interpretations of the thermodynamics characterizing biomolecular recognition
have marginalized the role of water. An important (even, perhaps, dominant) contribution to …

The dynamics of breaking and structural relaxation of Cl-− water, Br-− water and water−
water hydrogen bonds in aqueous alkali halide solutions are investigated by means of …