Molecular dynamics simulations are carried out to determine the effects of channel wall structure on water and ion properties. We compare hydrophobic (Lennard-Jones 5-3 and atomic) and molecular-hydrophilic cylindrical pores of 2-6 Å in effective radius
Molecular dynamics simulations are carried out to obtain estimates of diffusion coef®cients of biolo...
AbstractIon channels are gated, i.e. they can switch conformation between a closed and an open state...
A hydrophobic pore of subnanometer dimensions can appear impermeable to an ion even though its radiu...
The transbilayer pores formed by ion channel proteins contain extended columns of water molecules. T...
The transbilayer pores formed by ion channel proteins contain extended columns of water molecules. T...
AbstractBiological ion channels are nanoscale transmembrane pores. When water and ions are enclosed ...
A hydrophobic constriction site can act as an efficient barrier to ion and water permeation if its d...
Ion channel proteins form nanopores in biological membranes which allow the passage of ions and wate...
AbstractNarrow hydrophobic regions are a common feature of biological channels, with possible roles ...
Ion channels contain narrow columns of water molecules. It is of interest to compare the structure a...
The microscopic properties of water in narrow pores are relevant to the function of ion channels and...
AbstractNaturally occurring pores show a variety of polarities and sizes that are presumably directl...
This paper was presented at the 4th Micro and Nano Flows Conference (MNF2014), which was held at Uni...
Special Issue: Thermodynamics 2011 ConferenceInternational audienceWe report the self-diffusion coef...
AbstractThe theoretical prediction of water drying transitions near nonpolar surfaces has stimulated...
Molecular dynamics simulations are carried out to obtain estimates of diffusion coef®cients of biolo...
AbstractIon channels are gated, i.e. they can switch conformation between a closed and an open state...
A hydrophobic pore of subnanometer dimensions can appear impermeable to an ion even though its radiu...
The transbilayer pores formed by ion channel proteins contain extended columns of water molecules. T...
The transbilayer pores formed by ion channel proteins contain extended columns of water molecules. T...
AbstractBiological ion channels are nanoscale transmembrane pores. When water and ions are enclosed ...
A hydrophobic constriction site can act as an efficient barrier to ion and water permeation if its d...
Ion channel proteins form nanopores in biological membranes which allow the passage of ions and wate...
AbstractNarrow hydrophobic regions are a common feature of biological channels, with possible roles ...
Ion channels contain narrow columns of water molecules. It is of interest to compare the structure a...
The microscopic properties of water in narrow pores are relevant to the function of ion channels and...
AbstractNaturally occurring pores show a variety of polarities and sizes that are presumably directl...
This paper was presented at the 4th Micro and Nano Flows Conference (MNF2014), which was held at Uni...
Special Issue: Thermodynamics 2011 ConferenceInternational audienceWe report the self-diffusion coef...
AbstractThe theoretical prediction of water drying transitions near nonpolar surfaces has stimulated...
Molecular dynamics simulations are carried out to obtain estimates of diffusion coef®cients of biolo...
AbstractIon channels are gated, i.e. they can switch conformation between a closed and an open state...
A hydrophobic pore of subnanometer dimensions can appear impermeable to an ion even though its radiu...