Jonathan S. Mason

发表

Partition-based selection

Stephen D. Pickett, Jonathan S. Mason, J. Mason, 1996 .

FLAP: 4‐Point Pharmacophore Fingerprints from GRID

Jonathan S. Mason, Francesca Perruccio, Simone Sciabola, 2006 .

Understanding Ligand Binding Selectivity in a Prototypical GPCR Family

Chris de Graaf, Francesco L. Gervasio, Jonathan S. Mason, 2019, J. Chem. Inf. Model..

Decoding the Role of Water Dynamics in Ligand-Protein Unbinding: CRF1R as a Test Case

Jonathan S. Mason, Francesca Deflorian, Andrea Bortolato, 2015, J. Chem. Inf. Model..

Water Network Perturbation in Ligand Binding: Adenosine A2A Antagonists as a Case Study

Jonathan W. Essex, Michael S. Bodnarchuk, Jonathan S. Mason, 2013, J. Chem. Inf. Model..

Computer-assisted drug design

Jonathan S. Mason, 2007 .

Designing Compound Subsets: Comparison of Random and Rational Approaches Using Statistical Simulation

Willem P. van Hoorn, Jonathan S. Mason, Michael Snarey, 2007, J. Chem. Inf. Model..

Accurate Prediction of GPCR Ligand Binding Affinity with Free Energy Perturbation

Chris de Graaf, Herman van Vlijmen, Jonathan S. Mason, 2020, J. Chem. Inf. Model..

Ligand-Receptor 3-D Similarity Studies Using Multiple 4-Point Pharmacophores

Jonathan S. Mason, Daniel L. Cheney, J. Mason, 1998, Pacific Symposium on Biocomputing.

Pharmacophore Pattern Application in Virtual Screening. Library Design and QSAR

Andrew C. Good, Stephen D. Pickett, Jonathan S. Mason, 2000 .

Diversity Profiling and Design Using 3D Pharmacophores: Pharmacophore-Derived Queries (PDQ)

Stephen D. Pickett, Iain M. McLay, Jonathan S. Mason, 1996, J. Chem. Inf. Comput. Sci..

Chemistry Space Metrics in Diversity Analysis, Library Design, and Compound Selection

Jonathan S. Mason, Susanne Bauerschmidt, Paul R. Menard, 1998, J. Chem. Inf. Comput. Sci..

Three‐Dimensional Structure Database Searches

Andrew C. Good, Jonathan S. Mason, A. Good, 2007 .

Computational screening: large-scale drug discovery

Jonathan S. Mason, 1999 .

A Common Reference Framework for Analyzing/Comparing Proteins and Ligands. Fingerprints for Ligands And Proteins (FLAP): Theory and Application

Gabriele Cruciani, Jonathan S. Mason, Francesca Perruccio, 2007, J. Chem. Inf. Model..

GPCR-Bench: A Benchmarking Set and Practitioners' Guide for G Protein-Coupled Receptor Docking

Jonathan S. Mason, Andrea Bortolato, Dahlia R. Weiss, 2016, J. Chem. Inf. Model..

High-Throughput Virtual Screening of Proteins Using GRID Molecular Interaction Fields

James E. J. Mills, Gabriele Cruciani, Jonathan S. Mason, 2010, J. Chem. Inf. Model..

Rational Screening Set Design and Compound Selection: Cascaded Clustering

Jonathan S. Mason, Richard A. Lewis, Paul R. Menard, 1998, J. Chem. Inf. Comput. Sci..

Descriptors you can count on? Normalized and filtered pharmacophore descriptors for virtual screening

Andrew C. Good, Sung-Jin Cho, Jonathan S. Mason, 2004, J. Comput. Aided Mol. Des..

Iain M. McLay, Jonathan S. Mason, Richard A. Lewis, 1997, Journal of chemical information and computer sciences.

Discovery of 1,2,4-Triazine Derivatives as Adenosine A2A Antagonists using Structure Based Drug Design

Jonathan S. Mason, Christopher J. Langmead, S. P. Andrews, 2012, Journal of medicinal chemistry.

Iain M. McLay, Jonathan S. Mason, Richard A. Lewis, 2010 .

Progress in Structure Based Drug Design for G Protein-Coupled Receptors

Jonathan S. Mason, Christopher J. Langmead, Miles Congreve, 2011, Journal of medicinal chemistry.

Biophysical Mapping of the Adenosine A2A Receptor

Nathan Robertson, Jonathan S. Mason, S. P. Andrews, 2011, Journal of medicinal chemistry.

Intracellular allosteric antagonism of the CCR9 receptor

Ali Jazayeri, Jonathan S. Mason, Francesca Deflorian, 2016, Nature.

Use of Broad Biological Profiling as a Relevant Descriptor to Describe and Differentiate Compounds: Structure–In Vitro (Pharmacology–ADME)–In Vivo (Safety) Relationships

Jonathan S. Mason, Jacques Migeon, J. Mason, 2008 .

Article pubs.acs.org/jmc Identification of Novel Adenosine A 2A Receptor Antagonists by Virtual Screening

Nathan Robertson, Jonathan S. Mason, Christopher J. Langmead, 2022 .

A Common Reference Framework for Analyzing/Comparing Proteins and Ligands. Fingerprints for Liands and Proteins (FLAP): Theory and Application.

Gabriele Cruciani, Jonathan S. Mason, Francesca Perruccio, 2007 .

Crystal structure of the GLP-1 receptor bound to a peptide agonist

Ali Jazayeri, Jonathan S. Mason, Andrea Bortolato, 2017, Nature.

Structures of G protein-coupled receptors reveal new opportunities for drug discovery.

Jonathan S. Mason, J. Mason, F. Marshall, 2015, Drug discovery today.