Physical properties of mixed bilayers containing lamellar and nonlamellar lipids: insights from coarse-grain molecular dynamics simulations

Coarse-Grained (Multiscale) Simulations in Studies of Biophysical and Chemical Systems

(2011) Shina C.L. Kamerlin et al.   Annual Review of Physical Chemistry

Effect of membrane tension on the electric field and dipole potential of lipid bilayer membrane

(2011) Dora Toledo Warshaviak et al.   BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES

Determination of Electron Density Profiles and Area from Simulations of Undulating Membranes

(2011) Anthony R. Braun et al.   BIOPHYSICAL JOURNAL

Crystalline, Ordered and Disordered Lipid Membranes: Convergence of Stress Profiles due to Ergosterol

(2011) Juan M. Vanegas et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The ELBA Force Field for Coarse-Grain Modeling of Lipid Membranes

(2011) Mario Orsi et al.   PLoS One

Dual-resolution molecular dynamics simulation of antimicrobials in biomembranes

(2010) M. Orsi et al.   Journal of the Royal Society Interface

DNA Lipoplexes: Formation of the Inverse Hexagonal Phase Observed by Coarse-Grained Molecular Dynamics Simulation

(2010) Josephine Corsi et al.   LANGMUIR

Permeability of drugs and hormones through a lipid bilayer: insights from dual-resolution molecular dynamics

(2010) Mario Orsi et al.   Soft Matter

Molecular dynamics simulations of phase transition of lamellar lipid membrane in water under an electric field

(2010) Sheng Sun et al.   Soft Matter

Recent development in computer simulations of lipid bilayers

(2010) Alexander P. Lyubartsev et al.   Soft Matter

Undulation Contributions to the Area Compressibility in Lipid Bilayer Simulations

(2009) Qaiser Waheed et al.   BIOPHYSICAL JOURNAL

General formulation of pressure and stress tensor for arbitrary many-body interaction potentials under periodic boundary conditions

(2009) Aidan P. Thompson et al.   JOURNAL OF CHEMICAL PHYSICS

On the Validation of Molecular Dynamics Simulations of Saturated andcis-Monounsaturated Phosphatidylcholine Lipid Bilayers: A Comparison with Experiment

(2009) David Poger et al.   Journal of Chemical Theory and Computation

A new force field for simulating phosphatidylcholine bilayers

(2009) David Poger et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Permeability of Small Molecules through a Lipid Bilayer: A Multiscale Simulation Study

(2009) Mario Orsi et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Systematic Coarse-graining of a Multicomponent Lipid Bilayer

(2009) Lanyuan Lu et al.   JOURNAL OF PHYSICAL CHEMISTRY B

3D Pressure Field in Lipid Membranes and Membrane-Protein Complexes

(2009) O. H. Samuli Ollila et al.   PHYSICAL REVIEW LETTERS

Protein modulation of lipids, and vice-versa, in membranes

(2008) Derek Marsh   BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES

The Influence of 1-Alkanols and External Pressure on the Lateral Pressure Profiles of Lipid Bilayers

(2008) Beate Griepernau et al.   BIOPHYSICAL JOURNAL

Probing the Lipid Membrane Dipole Potential by Atomic Force Microscopy

(2008) Yi Yang et al.   BIOPHYSICAL JOURNAL

Lipid Bilayer Structure Determined by the Simultaneous Analysis of Neutron and X-Ray Scattering Data

(2008) Norbert Kučerka et al.   BIOPHYSICAL JOURNAL

Biomolecular simulations of membranes: Physical properties from different force fields

(2008) Shirley W. I. Siu et al.   JOURNAL OF CHEMICAL PHYSICS

Temperature Dependence of Structure, Bending Rigidity, and Bilayer Interactions of Dioleoylphosphatidylcholine Bilayers

(2007) Jianjun Pan et al.   BIOPHYSICAL JOURNAL

Prediction of Partition Coefficients by Multiscale Hybrid Atomic-Level/Coarse-Grain Simulations

(2007) Julien Michel et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A Quantitative Coarse-Grain Model for Lipid Bilayers

(2007) Mario Orsi et al.   JOURNAL OF PHYSICAL CHEMISTRY B