Iain M. McLay
Publications by Year
Research Areas
Computational Drug Discovery Methods, Estrogen and related hormone effects, Inflammatory mediators and NSAID effects, Receptor Mechanisms and Signaling, Neuropeptides and Animal Physiology
Most-Cited Works
- → GRid-INdependent Descriptors (GRIND): A Novel Class of Alignment-Independent Three-Dimensional Molecular Descriptors(2000)464 cited
- → Diversity Profiling and Design Using 3D Pharmacophores: Pharmacophore-Derived Queries (PDQ)(1996)154 cited
- → X-ray Crystal Structure of the Novel Enhanced-Affinity Glucocorticoid Agonist Fluticasone Furoate in the Glucocorticoid Receptor−Ligand Binding Domain(2008)112 cited
- → Enhancing the Hit-to-Lead Properties of Lead Optimization Libraries(1999)100 cited
- → Synthesis and Structure−Activity Relationships of Long-acting β2Adrenergic Receptor Agonists Incorporating Metabolic Inactivation: An Antedrug Approach(2010)98 cited
- → Progesterone Receptor Ligand Binding Pocket Flexibility: Crystal Structures of the Norethindrone and Mometasone Furoate Complexes(2004)87 cited
- → Similarity Measures for Rational Set Selection and Analysis of Combinatorial Libraries: The Diverse Property-Derived (DPD) Approach(1997)82 cited
- → Knowledge-Based Interaction Fingerprint Scoring: A Simple Method for Improving the Effectiveness of Fast Scoring Functions(2006)80 cited
- → Dissociated Nonsteroidal Glucocorticoid Receptor Modulators; Discovery of the Agonist Trigger in a Tetrahydronaphthalene−Benzoxazine Series(2006)77 cited
- → Drug Rings Database with Web Interface. A Tool for Identifying Alternative Chemical Rings in Lead Discovery Programs(2003)73 cited