Lista de obras -

A dual apolipoprotein C-II mimetic-apolipoprotein C-III antagonist peptide lowers plasma triglycerides

scientific article published on 01 January 2020

CHARMM36 Lipid Force Field with Explicit Treatment of Long-Range Dispersion: Parametrization and Validation for Phosphatidylethanolamine, Phosphatidylglycerol, and Ether Lipids

artículo científico publicado en 2021

Characterization of Specific Ion Effects on PI(4,5)P2 Clustering: Molecular Dynamics Simulations and Graph-Theoretic Analysis

scientific article published on 11 February 2020

Characterizing Residue-Bilayer Interactions Using Gramicidin A as a Scaffold and Tryptophan Substitutions as Probes

artículo científico publicado en 2017

Comparison of Additive and Polarizable Models with Explicit Treatment of Long-Range Lennard-Jones Interactions Using Alkane Simulations.

artículo científico publicado en 2017

Functional Group Distributions, Partition Coefficients, and Resistance Factors in Lipid Bilayers Using Site Identification by Ligand Competitive Saturation

artículo científico publicado en 2021

Graph-Theoretic Analysis of Monomethyl Phosphate Clustering in Ionic Solutions.

artículo científico publicado en 2018

Interactions of Water and Alkanes: Modifying Additive Force Fields to Account for Polarization Effects

scientific article published on 09 May 2019

Lipid and Peptide Diffusion in Bilayers: The Saffman-Delbrück Model and Periodic Boundary Conditions.

artículo científico publicado en 2016

Membrane Permeability: Characteristic Times and Lengths for Oxygen and a Simulation-Based Test of the Inhomogeneous Solubility-Diffusion Model

artículo científico publicado en 2018

Membrane permeability of small molecules from unbiased molecular dynamics simulations

artículo científico publicado en 2020

Molecular Dynamics Simulations of Membrane Permeability

scientific article published on 12 February 2019

Parameterization of the CHARMM All-Atom Force Field for Ether Lipids and Model Linear Ethers

artículo científico publicado en 2018

Permeability of membranes in the liquid ordered and liquid disordered phases

artículo científico publicado en 2019

Position-Dependent Diffusion Tensors in Anisotropic Media from Simulation: Oxygen Transport in and through Membranes.

artículo científico publicado en 2017

Quantitative Characterization of Protein-Lipid Interactions by Free Energy Simulation between Binary Bilayers

artículo científico publicado en 2019

Revisiting Volumes of Lipid Components in Bilayers

scientific article published on 18 March 2019

Semi-automated Optimization of the CHARMM36 Lipid Force Field to Include Explicit Treatment of Long-Range Dispersion

artículo científico publicado en 2021

Structure and Function in Antimicrobial Piscidins: Histidine Position, Directionality of Membrane Insertion, and pH-Dependent Permeabilization

artículo científico publicado en 2019

Surface Shear Viscosity and Interleaflet Friction from Nonequilibrium Simulations of Lipid Bilayers

scientific article published on 30 September 2019

Lista de obras de

A dual apolipoprotein C-II mimetic-apolipoprotein C-III antagonist peptide lowers plasma triglycerides

CHARMM36 Lipid Force Field with Explicit Treatment of Long-Range Dispersion: Parametrization and Validation for Phosphatidylethanolamine, Phosphatidylglycerol, and Ether Lipids

Characterization of Specific Ion Effects on PI(4,5)P2 Clustering: Molecular Dynamics Simulations and Graph-Theoretic Analysis

Characterizing Residue-Bilayer Interactions Using Gramicidin A as a Scaffold and Tryptophan Substitutions as Probes

Comparison of Additive and Polarizable Models with Explicit Treatment of Long-Range Lennard-Jones Interactions Using Alkane Simulations.

Functional Group Distributions, Partition Coefficients, and Resistance Factors in Lipid Bilayers Using Site Identification by Ligand Competitive Saturation

Graph-Theoretic Analysis of Monomethyl Phosphate Clustering in Ionic Solutions.

Interactions of Water and Alkanes: Modifying Additive Force Fields to Account for Polarization Effects

Lipid and Peptide Diffusion in Bilayers: The Saffman-Delbrück Model and Periodic Boundary Conditions.

Membrane Permeability: Characteristic Times and Lengths for Oxygen and a Simulation-Based Test of the Inhomogeneous Solubility-Diffusion Model

Membrane permeability of small molecules from unbiased molecular dynamics simulations

Molecular Dynamics Simulations of Membrane Permeability

Parameterization of the CHARMM All-Atom Force Field for Ether Lipids and Model Linear Ethers

Permeability of membranes in the liquid ordered and liquid disordered phases

Position-Dependent Diffusion Tensors in Anisotropic Media from Simulation: Oxygen Transport in and through Membranes.

Quantitative Characterization of Protein-Lipid Interactions by Free Energy Simulation between Binary Bilayers

Revisiting Volumes of Lipid Components in Bilayers

Semi-automated Optimization of the CHARMM36 Lipid Force Field to Include Explicit Treatment of Long-Range Dispersion

Structure and Function in Antimicrobial Piscidins: Histidine Position, Directionality of Membrane Insertion, and pH-Dependent Permeabilization

Surface Shear Viscosity and Interleaflet Friction from Nonequilibrium Simulations of Lipid Bilayers