Simon J. F. Macdonald

According to our database, Simon J. F. Macdonald authored at least 4 papers between 2009 and 2020.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2020

Molecular Simulation of αvβ6 Integrin Inhibitors.

Ellen E. Guest, Steven A. Oatley, Simon J. F. Macdonald, Jonathan D. Hirst

J. Chem. Inf. Model., 2020

2010

Lead Optimization Using Matched Molecular Pairs: Inclusion of Contextual Information for Enhanced Prediction of hERG Inhibition, Solubility, and Lipophilicity.

George Papadatos, Muhammad Alkarouri, Valerie J. Gillet, Peter Willett, Visakan Kadirkamanathan, Christopher N. Luscombe, Gianpaolo Bravi, Nicola J. Richmond, Stephen D. Pickett, Jameed Hussain, John Pritchard, Anthony W. J. Cooper, Simon J. F. Macdonald

J. Chem. Inf. Model., 2010

2009

Analysis of the Calculated Physicochemical Properties of Respiratory Drugs: Can We Design for Inhaled Drugs Yet?

Timothy J. Ritchie, Christopher N. Luscombe, Simon J. F. Macdonald

J. Chem. Inf. Model., 2009

Analysis of Neighborhood Behavior in Lead Optimization and Array Design.

George Papadatos, Anthony W. J. Cooper, Visakan Kadirkamanathan, Simon J. F. Macdonald, Iain M. McLay, Stephen D. Pickett, John Pritchard, Peter Willett, Valerie J. Gillet

J. Chem. Inf. Model., 2009