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 …

Terahertz spectroscopy for quantification of free water and bound water in leaf

Z Zang, Z Li, X Lu, J Liang, J Wang, HL Cui… - … and Electronics in …, 2021 - Elsevier
The water in a plant is known to exist as free water and bound water, and the proportional
change between the two forms is an important indicator of the physiological state of the …

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

S Pal, S Balasubramanian, B Bagchi - Physical Review E, 2003 - APS
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 …

Cleavage of RNA by an amphiphilic compound lacking traditional catalytic groups

NA Kovalev, DA Medvedeva, MA Zenkova… - Bioorganic chemistry, 2008 - Elsevier
Recently, in experiments with combinatorial libraries of amphiphilic compounds lacking
groups, known as catalysts of transesterification reaction, we discovered novel RNA …

Effect of discrete macroion charge distributions in solutions of like-charged macroions

K Qamhieh, P Linse - The journal of chemical physics, 2005 - pubs.aip.org
The effect of replacing the conventional uniform macroion surface charge density with
discrete macroion charge distributions on structural properties of aqueous solutions of like …

Dynamics of water at the interface of a small protein, enterotoxin

S Balasubramanian, S Bandyopadhyay, S Pal… - Current Science, 2003 - JSTOR
Fully atomistic molecular dynamics simulations have been carried out to investigate the
correlation of biological activity with dynamics of water molecules in an aqueous protein …

Identity, energy, environment, and dynamics of interfacial watermolecules in a micellar solution

S Balasubramanian, S Pal, B Bagchi - Journal of the Indian …, 2003 - journal.iisc.ac.in
The structure and energetics of interfacial water molecules in the aqueous micelle of cesium
perfluorooctanoate have been investigated using-large scale atomistic molecular dynamics …

Defining the micelle/water interface using computational and experimental results

MF Vitha - Interfaces and Interphases in Analytical Chemistry, 2011 - ACS Publications
Surfactant micelles are used throughout analytical chemistry and in separation science
specifically to improve the performance of a wide range of techniques. Within separation …

[引用][C] Theoretical and computational modeling of the dynamics of multicellular and lipid membrane systems

M McCune - 2016 - University of Missouri--Columbia