Lista de obras - Toby W Allen - Dominio Público Uruguay

A model of calcium channels

scientific article published on 01 December 2000

A selectivity filter at the intracellular end of the acid-sensing ion channel pore

artículo científico publicado en 2017

Assessing atomistic and coarse-grained force fields for protein-lipid interactions: the formidable challenge of an ionizable side chain in a membrane.

artículo científico publicado en 2008

Atomistic Simulations of Membrane Ion Channel Conduction, Gating, and Modulation

scientific article published on 27 June 2019

Comment on "Free energy simulations of single and double ion occupancy in gramicidin A" [J. Chem. Phys. 126, 105103 (2007)].

artículo científico publicado en 2008

Comparison of permeation mechanisms in sodium-selective ion channels

artículo científico publicado en 2018

Computational Models for Predictive Cardiac Ion Channel Pharmacology.

artículo científico publicado en 2014

Conducting-state properties of the KcsA potassium channel from molecular and Brownian dynamics simulations.

artículo científico publicado en 2002

Electrostatics of deformable lipid membranes

artículo científico publicado en 2010

Estimation of Potentials of Mean Force from Nonequilibrium Pulling Simulations Using Both Minh-Adib Estimator and Weighted Histogram Analysis Method.

artículo científico publicado en 2016

Gramicidin A channel as a test ground for molecular dynamics force fields

artículo científico publicado en 2003

Identification of electric-field-dependent steps in the Na(+),K(+)-pump cycle

artículo científico publicado en 2014

Ion conduction and conformational flexibility of a bacterial voltage-gated sodium channel

artículo científico publicado en 2014

Ion-induced defect permeation of lipid membranes

artículo científico publicado en 2014

Local anesthetic and antiepileptic drug access and binding to a bacterial voltage-gated sodium channel

artículo científico publicado en 2014

Mechanism of potassium-channel selectivity revealed by Na+ and Li+ binding sites within the KcsA pore

artículo científico publicado en 2009

Membrane Protein Structure, Function, and Dynamics: a Perspective from Experiments and Theory.

artículo científico publicado en 2015

Membrane protein structure and function

artículo científico publicado en 2011

Modeling charged protein side chains in lipid membranes.

artículo científico publicado en 2007

Modeling diverse range of potassium channels with Brownian dynamics.

artículo científico publicado en 2002

On the importance of atomic fluctuations, protein flexibility, and solvent in ion permeation

artículo científico publicado en 2004

On the role of anionic lipids in charged protein interactions with membranes ⬇️

artículo científico publicado el 10 de noviembre de 2010

On the selective ion binding hypothesis for potassium channels

artículo científico publicado en 2011

On the thermodynamic stability of a charged arginine side chain in a transmembrane helix

artículo científico publicado en 2007

Origins of ion selectivity in potassium channels from the perspective of channel block.

artículo científico publicado en 2011

Permeation of ions across the potassium channel: Brownian dynamics studies

artículo científico publicado en 1999

Polarization Effects in Water-Mediated Selective Cation Transport across a Narrow Transmembrane Channel

artículo científico publicado en 2021

Positronium states in three-dimensional QED

artículo científico publicado en 1996

Selective ion permeation involves complexation with carboxylates and lysine in a model human sodium channel

scientific article published on 12 September 2018

Simulating ion channel activation mechanisms using swarms of trajectories

artículo científico publicado en 2019

String method solution of the gating pathways for a pentameric ligand-gated ion channel.

artículo científico publicado en 2017

Structure of gramicidin a in a lipid bilayer environment determined using molecular dynamics simulations and solid-state NMR data

artículo científico publicado en 2003

The Role of Atomic Polarization in the Thermodynamics of Chloroform Partitioning to Lipid Bilayers.

artículo científico publicado en 2012

The determinants of hydrophobic mismatch response for transmembrane helices

scientific article published on 17 September 2012

The different interactions of lysine and arginine side chains with lipid membranes

artículo científico publicado en 2013

The role of membrane thickness in charged protein-lipid interactions.

artículo científico publicado en 2011

The role of tryptophan side chains in membrane protein anchoring and hydrophobic mismatch.

artículo científico publicado en 2012

The voltage-sensitive dye RH421 detects a Na+,K+-ATPase conformational change at the membrane surface.

artículo científico publicado en 2017

Towards a Structural View of Drug Binding to hERG K(+) Channels

artículo científico publicado en 2017

Understanding Sodium Channel Function and Modulation Using Atomistic Simulations of Bacterial Channel Structures.

artículo científico publicado en 2016

Lista de obras de Toby W Allen

A model of calcium channels

A selectivity filter at the intracellular end of the acid-sensing ion channel pore

Assessing atomistic and coarse-grained force fields for protein-lipid interactions: the formidable challenge of an ionizable side chain in a membrane.

Atomistic Simulations of Membrane Ion Channel Conduction, Gating, and Modulation

Comment on "Free energy simulations of single and double ion occupancy in gramicidin A" [J. Chem. Phys. 126, 105103 (2007)].

Comparison of permeation mechanisms in sodium-selective ion channels

Computational Models for Predictive Cardiac Ion Channel Pharmacology.

Conducting-state properties of the KcsA potassium channel from molecular and Brownian dynamics simulations.

Electrostatics of deformable lipid membranes

Estimation of Potentials of Mean Force from Nonequilibrium Pulling Simulations Using Both Minh-Adib Estimator and Weighted Histogram Analysis Method.

Gramicidin A channel as a test ground for molecular dynamics force fields

Identification of electric-field-dependent steps in the Na(+),K(+)-pump cycle

Ion conduction and conformational flexibility of a bacterial voltage-gated sodium channel

Ion-induced defect permeation of lipid membranes

Local anesthetic and antiepileptic drug access and binding to a bacterial voltage-gated sodium channel

Mechanism of potassium-channel selectivity revealed by Na+ and Li+ binding sites within the KcsA pore

Membrane Protein Structure, Function, and Dynamics: a Perspective from Experiments and Theory.

Membrane protein structure and function

Modeling charged protein side chains in lipid membranes.

Modeling diverse range of potassium channels with Brownian dynamics.

On the importance of atomic fluctuations, protein flexibility, and solvent in ion permeation

On the role of anionic lipids in charged protein interactions with membranes ⬇️

On the selective ion binding hypothesis for potassium channels

On the thermodynamic stability of a charged arginine side chain in a transmembrane helix

Origins of ion selectivity in potassium channels from the perspective of channel block.

Permeation of ions across the potassium channel: Brownian dynamics studies

Polarization Effects in Water-Mediated Selective Cation Transport across a Narrow Transmembrane Channel

Positronium states in three-dimensional QED

Selective ion permeation involves complexation with carboxylates and lysine in a model human sodium channel

Simulating ion channel activation mechanisms using swarms of trajectories

String method solution of the gating pathways for a pentameric ligand-gated ion channel.

Structure of gramicidin a in a lipid bilayer environment determined using molecular dynamics simulations and solid-state NMR data

The Role of Atomic Polarization in the Thermodynamics of Chloroform Partitioning to Lipid Bilayers.

The determinants of hydrophobic mismatch response for transmembrane helices

The different interactions of lysine and arginine side chains with lipid membranes

The role of membrane thickness in charged protein-lipid interactions.

The role of tryptophan side chains in membrane protein anchoring and hydrophobic mismatch.

The voltage-sensitive dye RH421 detects a Na+,K+-ATPase conformational change at the membrane surface.

Towards a Structural View of Drug Binding to hERG K(+) Channels

Understanding Sodium Channel Function and Modulation Using Atomistic Simulations of Bacterial Channel Structures.