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 …

The reorientation of a water molecule is important for a host of phenomena, ranging over—in
an only partial listing—the key dynamic hydrogen-bond network restructuring of water itself …

We show graphene oxide (GO) greatly suppresses the growth and recrystallization of ice
crystals, and ice crystals display a hexagonal shape in the GO dispersion. Preferred …

The dynamics of water molecules next to hydrophobic solutes is investigated, specifically
addressing the recent controversy raised by the first time-resolved observations, which …

The structure of water in the hydration shells of small hydrophobic solutes was investigated
through molecular dynamics. The results show that a subset of water molecules in the first …

The dynamics of hydrogen bonds among water molecules themselves and with the polar
head groups (PHG) at a micellar surface have been investigated by long molecular …

A molecular simulation study is reported for water desalination in zeolitic imidazolate
framework-8 (ZIF-8) membrane. The simulation demonstrates that water desalination occurs …

A series of 2D functional covalent–organic framework (COF) membranes are
computationally designed from an experimentally synthesized COF (TpPa-1) for water …

Water around biomolecules slows down with respect to pure water, and both rotation and
translation exhibit anomalous time dependence in the hydration shell. The origin of such …

A molecular simulation study is reported for water desalination through five zeolitic
imidazolate framework (ZIF) membranes, namely ZIF-25,-71,-93,-96, and-97. The five ZIFs …