Water dynamics in the hydration layer around proteins and micelles
B Bagchi - Chemical Reviews, 2005 - ACS Publications
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 …
selfassemblies and proteins in aqueous solutions. This topic has not only seen a vigorous …
Protein hydration dynamics in solution: a critical survey
B Halle - Philosophical Transactions of the Royal Society …, 2004 - royalsocietypublishing.org
The properties of water in biological systems have been studied for well over a century by a
wide range of physical techniques, but progress has been slow and erratic. Protein …
wide range of physical techniques, but progress has been slow and erratic. Protein …
Hydrogen-Bond Dynamics near a Micellar Surface: Origin of the Universal Slow Relaxation<? format?> at Complex Aqueous Interfaces
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 …
head groups (PHG) at a micellar surface have been investigated by long molecular …
Protein unfolding by SDS: the microscopic mechanisms and the properties of the SDS-protein assembly
The effects of detergent sodium dodecyl sulfate (SDS) on protein structure and dynamics are
fundamental to the most common laboratory technique used to separate proteins and …
fundamental to the most common laboratory technique used to separate proteins and …
Molecular aggregates in aqueous solutions of bile acid salts. Molecular dynamics simulation study
The aggregation behavior of two bile acid salts (ie, sodium cholate and sodium
deoxycholate) has been studied in their aqueous solutions of three different concentrations …
deoxycholate) has been studied in their aqueous solutions of three different concentrations …
Molecular view of water dynamics near model peptides
D Russo, RK Murarka, JRD Copley… - The Journal of …, 2005 - ACS Publications
Incoherent quasi-elastic neutron scattering (QENS) has been used to measure the dynamics
of water molecules in solutions of a model protein backbone, N-acetyl-glycine-methylamide …
of water molecules in solutions of a model protein backbone, N-acetyl-glycine-methylamide …
Membrane protein dynamics versus environment: simulations of OmpA in a micelle and in a bilayer
PJ Bond, MSP Sansom - Journal of molecular biology, 2003 - Elsevier
The bacterial outer membrane protein OmpA is one of the few membrane proteins whose
structure has been solved both by X-ray crystallography and by NMR. Crystals were …
structure has been solved both by X-ray crystallography and by NMR. Crystals were …
How proteins modify water dynamics
The dynamics of the protein-water interface is of fundamental importance for many biological
processes. Accordingly, a wide array of experimental techniques have been deployed in the …
processes. Accordingly, a wide array of experimental techniques have been deployed in the …
An algorithm to describe molecular scale rugged surfaces and its application to the study of a water/lipid bilayer interface
SA Pandit, D Bostick, ML Berkowitz - The Journal of chemical physics, 2003 - pubs.aip.org
We propose an algorithm for the general description of rugged molecular scale interfacial
surfaces. This algorithm was implemented in the description of a phospholipid …
surfaces. This algorithm was implemented in the description of a phospholipid …
Dynamics of bound and free water in an aqueous micellar solution: Analysis of the lifetime and vibrational frequencies of hydrogen bonds at a complex interface
In order to understand the nature and dynamics of interfacial water molecules on the surface
of complex systems, large scale, fully atomistic molecular dynamics simulations of an …
of complex systems, large scale, fully atomistic molecular dynamics simulations of an …