The Molecular Basis of Polyunsaturated Fatty Acid Interactions with the Shaker Voltage-Gated Potassium Channel

Polyunsaturated fatty acid analogs act antiarrhythmically on the cardiac IKschannel

(2015) Sara I. Liin et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Migration of PIP2 lipids on voltage-gated potassium channel surface influences channel deactivation

(2015) Liping Chen et al.   Scientific Reports

Drug-induced ion channel opening tuned by the voltage sensor charge profile

(2014) Nina E. Ottosson et al.   JOURNAL OF GENERAL PHYSIOLOGY

GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit

(2013) Sander Pronk et al.   BIOINFORMATICS

Energetic role of the paddle motif in voltage gating of Shaker K+ channels

(2013) Yanping Xu et al.   NATURE STRUCTURAL & MOLECULAR BIOLOGY

Optimization of the Additive CHARMM All-Atom Protein Force Field Targeting Improved Sampling of the Backbone ϕ, ψ and Side-Chain χ1 and χ2 Dihedral Angles

(2012) Robert B. Best et al.   Journal of Chemical Theory and Computation

Tracking a complete voltage-sensor cycle with metal-ion bridges

(2012) U. Henrion et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Mechanism of Voltage Gating in Potassium Channels

(2012) M. O. Jensen et al.   SCIENCE

MATCH: An atom-typing toolset for molecular mechanics force fields

(2011) Joseph D. Yesselman et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

An electrostatic potassium channel opener targeting the final voltage sensor transition

(2011) Sara I. Börjesson et al.   JOURNAL OF GENERAL PHYSIOLOGY

Structural Dynamics of the S4 Voltage-Sensor Helix in Lipid Bilayers Lacking Phosphate Groups

(2011) Magnus Andersson et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Intermediate states of the Kv1.2 voltage sensor from atomistic molecular dynamics simulations

(2011) L. Delemotte et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Electrostatic Tuning of Cellular Excitability

(2010) Sara I. Börjesson et al.   BIOPHYSICAL JOURNAL

RNA editing modulates the binding of drugs and highly unsaturated fatty acids to the open pore of Kv potassium channels

(2010) Niels Decher et al.   EMBO JOURNAL

g_membed: Efficient insertion of a membrane protein into an equilibrated lipid bilayer with minimal perturbation

(2010) Maarten G. Wolf et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Statistical potentials for fold assessment

(2010) Francisco Melo et al.   PROTEIN SCIENCE

Interactions between lipids and voltage sensor paddles detected with tarantula toxins

(2009) Mirela Milescu et al.   NATURE STRUCTURAL & MOLECULAR BIOLOGY

Lipoelectric Modification of Ion Channel Voltage Gating by Polyunsaturated Fatty Acids

(2008) Sara I. Börjesson et al.   BIOPHYSICAL JOURNAL

Polyunsaturated Fatty Acid Modulation of Voltage-Gated Ion Channels

(2008) Linda M. Boland et al.   CELL BIOCHEMISTRY AND BIOPHYSICS

Acyl chain conformations in phospholipid bilayers: a comparative study of docosahexaenoic acid and saturated fatty acids

(2008) Scott E. Feller   CHEMISTRY AND PHYSICS OF LIPIDS

Polyunsaturated fatty acids and cerebrospinal fluid from children on the ketogenic diet open a voltage-gated K channel: A putative mechanism of antiseizure action

(2008) Xiang-ping Xu et al.   EPILEPSY RESEARCH

GROMACS 4:  Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

(2008) Berk Hess et al.   Journal of Chemical Theory and Computation

P-LINCS:  A Parallel Linear Constraint Solver for Molecular Simulation

(2007) Berk Hess   Journal of Chemical Theory and Computation