| CHAP: a versatile tool for the structural and functional annotation of ion channel pores G Klesse, S Rao, MSP Sansom, SJ Tucker Journal of molecular biology 431 (17), 3353-3365, 2019 | 107 | 2019 |
| Functional annotation of ion channel structures by molecular simulation JL Trick, S Chelvaniththilan, G Klesse, P Aryal, EJ Wallace, SJ Tucker, ... Structure 24 (12), 2207-2216, 2016 | 62 | 2016 |
| A heuristic derived from analysis of the ion channel structural proteome permits the rapid identification of hydrophobic gates S Rao, G Klesse, PJ Stansfeld, SJ Tucker, MSP Sansom Proceedings of the National Academy of Sciences 116 (28), 13989-13995, 2019 | 59 | 2019 |
| Water and hydrophobic gates in ion channels and nanopores S Rao, CI Lynch, G Klesse, GE Oakley, PJ Stansfeld, SJ Tucker, ... Faraday discussions 209, 231-247, 2018 | 50 | 2018 |
| Induced Polarization in Molecular Dynamics Simulations of the 5-HT3 Receptor Channel G Klesse, S Rao, SJ Tucker, MSP Sansom Journal of the American Chemical Society 142 (20), 9415-9427, 2020 | 47 | 2020 |
| Electric field induced wetting of a hydrophobic gate in a model nanopore based on the 5-HT3 receptor channel G Klesse, SJ Tucker, M Sansom ACS Nano 14 (8), 10480–10491, 2020 | 29 | 2020 |
| Molecular Simulations of Hydrophobic Gating of Pentameric Ligand Gated Ion Channels: Insights into Water and Ions S Rao, G Klesse, CI Lynch, SJ Tucker, MSP Sansom The Journal of Physical Chemistry B 125 (4), 981-994, 2021 | 27 | 2021 |
| Heteromeric GABAA receptor structures in positively-modulated active states PS Miller, S Masiulis, T Malinauskas, A Kotecha, S Rao, S Chavali, ... bioRxiv, 338343, 2018 | 21 | 2018 |
| A BEST example of channel structure annotation by molecular simulation S Rao, G Klesse, PJ Stansfeld, SJ Tucker, MSP Sansom Channels 11 (4), 347-353, 2017 | 21 | 2017 |
| Water Nanoconfined in a Hydrophobic Pore: Molecular Dynamics Simulations of Transmembrane Protein 175 and the Influence of Water Models CI Lynch, G Klesse, S Rao, SJ Tucker, MSP Sansom ACS nano 15 (12), 19098-19108, 2021 | 17 | 2021 |
| A newly available tool for functional annotation of ion channel structures based on molecular dynamics simulations G Klesse, S Rao, PJ Stansfeld, MSP Sansom, SJ Tucker Biophysical Journal 114 (3), 134a, 2018 | 3 | 2018 |
| Hydrophobic gating and functional annotation of ion channels G Klesse University of Oxford, 2019 | 2 | 2019 |
| Identification of Hydrophobic Gates by Simulation-Enabled Analysis of the Ion Channel Structural Proteome S Rao, G Klesse, PJ Stansfeld, SJ Tucker, MSP Sansom bioRxiv, 498386, 2018 | 1 | 2018 |
| Modelling Water Behaviour in Hydrophobic Gates of Ion Channels CI Lynch, S Rao, G Klesse, SJ Tucker, MSP Sansom Biophysical Journal 120 (3), 157a, 2021 | | 2021 |
| Water nanoconfined in a hydrophobic pore: MD simulations of the TMEM175 channel and the influence of water models CI Lynch, G Klesse, S Rao, S Tucker, MSP Sansom ACS Nano, 2021 | | 2021 |
| Water Nanoconfined in a Hydrophobic Pore: MD Simulations and Water Models CI Lynch, G Klesse, S Rao, SJ Tucker, MSP Sansom bioRxiv, 2021 | | 2021 |
| Annotating Ion Channel Pores: Structures, Hydrophobicity and the Threshold for Permeation S Rao, G Klesse, SJ Tucker, MSP Sansom Biophysical Journal 118 (3), 272a, 2020 | | 2020 |
| Simulations of hydrophobic gating in an ion channel: TMEM175 C Lynch, S Rao, G Klesse, M Sansom ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019 | | 2019 |
| Functional Annotation of Ion Channel Structures: Predicting Pore Solvation States Based on Local Radius and Hydrophobicity S Rao, G Klesse, PJ Stansfeld, SJ Tucker, MSP Sansom Biophysical Journal 116 (3), 241a, 2019 | | 2019 |
| Hydrophobic Gating: Examination of Recent Ion Channel Structures S Rao, G Klesse, SJ Tucker, MSP Sansom Biophysical Journal 114 (3), 134a, 2018 | | 2018 |
Mark S.P. SansomUniversity of OxfordVerified email at bioch.ox.ac.uk
