| New approaches for computing ligand–receptor binding kinetics NJ Bruce, GK Ganotra, DB Kokh, SK Sadiq, RC Wade Current opinion in structural biology 49, 1-10, 2018 | 139 | 2018 |
| Prediction of drug–target binding kinetics by comparative binding energy analysis GK Ganotra, RC Wade ACS medicinal chemistry letters 9 (11), 1134-1139, 2018 | 50 | 2018 |
| Halogen–aromatic π interactions modulate inhibitor residence times C Heroven, V Georgi, GK Ganotra, P Brennan, F Wolfreys, RC Wade, ... Angewandte Chemie International Edition 57 (24), 7220-7224, 2018 | 48 | 2018 |
| KBbox: A toolbox of computational methods for studying the kinetics of molecular binding NJ Bruce, GK Ganotra, S Richter, RC Wade Journal of chemical information and modeling 59 (9), 3630-3634, 2019 | 20 | 2019 |
| Computational studies of drug-binding kinetics GK Ganotra | 3 | 2020 |
| A protocol to use comparative binding energy analysis to estimate drug-target residence time GK Ganotra, A Nunes-Alves, RC Wade Protein-Ligand Interactions and Drug Design, 171-186, 2021 | 1 | 2021 |
| Halogenaromatische π‐Wechselwirkungen modulieren die Verweilzeit von Inhibitoren C Heroven, V Georgi, GK Ganotra, P Brennan, F Wolfreys, RC Wade, ... Angewandte Chemie 130 (24), 7338-7343, 2018 | 1 | 2018 |
| Second Part of the Practical on Brownian Dynamics Simulation Brownian Dynamics Simulations: Rate of Association of Barnase and Barstar N Bruce, G Ganotra, R Wade | | |
| First Part of the Practical on Brownian Dynamics Simulation Protein Electrostatic Potentials: Calculation with APBS and Analysis N Bruce, G Ganotra, R Wade | | |
