Ian D. Wall

Publications by Year

Research Areas

Protein Structure and Dynamics, Protein Degradation and Inhibitors, Computational Drug Discovery Methods, Multiple Myeloma Research and Treatments, Enzyme Structure and Function

Most-Cited Works

• → A Critical Assessment of Docking Programs and Scoring Functions(2005)1,688 cited
• → Exploring Ligand Stability in Protein Crystal Structures Using Binding Pose Metadynamics(2020)135 cited
• → Rapid and Reliable Binding Affinity Prediction of Bromodomain Inhibitors: A Computational Study(2016)81 cited
• → Binding Constants of Neuraminidase Inhibitors: An Investigation of the Linear Interaction Energy Method(1999)73 cited
• → Discovery of a Bromodomain and Extraterminal Inhibitor with a Low Predicted Human Dose through Synergistic Use of Encoded Library Technology and Fragment Screening(2020)70 cited
• → The Optimization of a Novel, Weak Bromo and Extra Terminal Domain (BET) Bromodomain Fragment Ligand to a Potent and Selective Second Bromodomain (BD2) Inhibitor(2020)63 cited
• → Bioinformatics and molecular modelling approaches to GPCR oligomerization(2009)63 cited
• → Design and Synthesis of a Highly Selective and In Vivo-Capable Inhibitor of the Second Bromodomain of the Bromodomain and Extra Terminal Domain Family of Proteins(2020)52 cited
• → Discovery of a Highly Selective BET BD2 Inhibitor from a DNA-Encoded Library Technology Screening Hit(2021)45 cited
• → Mycobacterium tuberculosis Decaprenylphosphoryl-β-d-ribose Oxidase Inhibitors: Expeditious Reconstruction of Suboptimal Hits into a Series with Potent in Vivo Activity(2020)32 cited