Hydrophobic gating and functional annotation of ion channels by Klesse, G

CHAP: A versatile tool for the structural and functional annotation of ion channel pores by Klesse, G, Rao, S, Sansom, M, Tucker, S

Electric field induced wetting of a hydrophobic gate in a model nanopore based on the 5-HT3 receptor channel by Klesse, G, Tucker, SJ, Sansom, MSP

Induced polarization in molecular dynamics simulations of the 5-HT3 receptor channel by Klesse, G, Rao, S, Tucker, SJ, Sansom, MSP

Induced polarization in MD simulations of the 5HT3 receptor channel by Klesse, G, Rao, S, Tucker, SJ, Sansom, MSP

A BEST example of channel structure annotation by molecular simulation by Rao, S, Klesse, G, Stansfeld, P, Tucker, S, Sansom, M

Water nanoconfined in a hydrophobic pore: molecular dynamics simulations of transmembrane protein 175 and the influence of water models by Lynch, CI, Klesse, G, Rao, S, Tucker, S, Sansom, MSP

Molecular simulations of hydrophobic gating of pentameric ligand gated ion channels: Insights into water and ions by Rao, S, Klesse, G, Lynch, CI, Tucker, SJ, Sansom, M

Water nanoconfined in a hydrophobic pore: molecular dynamics simulations of transmembrane protein 175 and the influence of water models by Lynch, CI, Klesse, G, Rao, S, Tucker, SJ, Sansom, MSP

A heuristic derived from analysis of the ion channel structural proteome permits the rapid identification of hydrophobic gates by Rao, S, Klesse, G, Stansfeld, PJ, Tucker, SJ, Sansom, M

Functional annotation of ion channel structures by molecular simulation by Trick, J, Chelvaniththilan, S, Klesse, G, Aryal, P, Wallace, E, Tucker, S, Sansom, M

Water and hydrophobic gates in ion channels and nanopores by Rao, S, Lynch, C, Klesse, G, Oakley, GE, Stansfeld, PJ, Tucker, SJ, Sansom, MSP