Peter W. Kenny

According to our database, Peter W. Kenny authored at least 12 papers between 1994 and 2022.

Collaborative distances:

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

2022

Assessment of Reversibility for Covalent Cysteine Protease Inhibitors Using Quantum Mechanics/Molecular Mechanics Free Energy Surfaces.

Alberto M. dos Santos, Amanda Ruslana Santana Oliveira, Clauber Henrique Costa, Peter W. Kenny, Carlos A. Montanari, Jaldyr de Jesus G. Varela, Jerônimo Lameira

J. Chem. Inf. Model., 2022

2019

The nature of ligand efficiency.

Peter W. Kenny

J. Cheminformatics, 2019

2017

Comment on The Ecstasy and Agony of Assay Interference Compounds.

Peter W. Kenny

J. Chem. Inf. Model., November, 2017

The influence of hydrogen bonding on partition coefficients.

Nádia Melo Borges, Peter W. Kenny, Carlos A. Montanari, Igor M. Prokopczyk, Jean F. R. Ribeiro, Josmar R. Rocha, Geraldo Rodrigues Sartori

J. Comput. Aided Mol. Des., 2017

2014

Ligand efficiency metrics considered harmful.

Peter W. Kenny, Andrei Leitão, Carlos A. Montanari

J. Comput. Aided Mol. Des., 2014

2013

Automated molecule editing in molecular design.

Peter W. Kenny, Carlos A. Montanari, Igor M. Prokopczyk, Fernanda A. Sala, Geraldo Rodrigues Sartori

J. Comput. Aided Mol. Des., 2013

ClogPalk: a method for predicting alkane/water partition coefficient.

Peter W. Kenny, Carlos A. Montanari, Igor M. Prokopczyk

J. Comput. Aided Mol. Des., 2013

Inflation of correlation in the pursuit of drug-likeness.

Peter W. Kenny, Carlos A. Montanari

J. Comput. Aided Mol. Des., 2013

2012

Computation, experiment and molecular design.

Peter W. Kenny

J. Comput. Aided Mol. Des., 2012

2009

Hydrogen Bonding, Electrostatic Potential, and Molecular Design.

Peter W. Kenny

J. Chem. Inf. Model., 2009

Design of compound libraries for fragment screening.

Niklas Blomberg, David A. Cosgrove, Peter W. Kenny, Karin Kolmodin

J. Comput. Aided Mol. Des., 2009

1994

Pharmacophoric pattern matching in files of three-dimensional chemical structures: Comparison of conformational-searching algorithms for flexible searching.

David E. Clark, Gareth Jones, Peter Willett, Peter W. Kenny, Robert C. Glen

J. Chem. Inf. Comput. Sci., 1994