Peter W. Kenny

12 papers Journal 12

Year	Rank	Type	Title / Venue / Authors
2022	J	`jnl`	Assessment of Reversibility for Covalent Cysteine Protease Inhibitors Using Quantum Mechanics/Molecular Mechanics Free Energy Surfaces. J. Chem. Inf. Model. Alberto M. dos Santos, Amanda Ruslana Santana Oliveira, Clauber Henrique Costa, Peter W. Kenny, Carlos Alberto Montanari, Jaldyr de Jesus G. Varela, Jerônimo Lameira
2019	J	`jnl`	The nature of ligand efficiency. J. Cheminformatics Peter W. Kenny
2017	J	`jnl`	Comment on The Ecstasy and Agony of Assay Interference Compounds. J. Chem. Inf. Model. Peter W. Kenny
2017	J	`jnl`	The influence of hydrogen bonding on partition coefficients. J. Comput. Aided Mol. Des. Nádia Melo Borges, Peter W. Kenny, Carlos Alberto Montanari, Igor M. Prokopczyk, Jean F. R. Ribeiro, Josmar R. Rocha, Geraldo Rodrigues Sartori
2014	J	`jnl`	Ligand efficiency metrics considered harmful. J. Comput. Aided Mol. Des. Peter W. Kenny, Andrei Leitão, Carlos Alberto Montanari
2013	J	`jnl`	Automated molecule editing in molecular design. J. Comput. Aided Mol. Des. Peter W. Kenny, Carlos Alberto Montanari, Igor M. Prokopczyk, Fernanda A. Sala, Geraldo Rodrigues Sartori
2013	J	`jnl`	ClogPalk: a method for predicting alkane/water partition coefficient. J. Comput. Aided Mol. Des. Peter W. Kenny, Carlos Alberto Montanari, Igor M. Prokopczyk
2013	J	`jnl`	Inflation of correlation in the pursuit of drug-likeness. J. Comput. Aided Mol. Des. Peter W. Kenny, Carlos Alberto Montanari
2012	J	`jnl`	Computation, experiment and molecular design. J. Comput. Aided Mol. Des. Peter W. Kenny
2009	J	`jnl`	Design of compound libraries for fragment screening. J. Comput. Aided Mol. Des. Niklas Blomberg, David A. Cosgrove, Peter W. Kenny, Karin Kolmodin
2009	J	`jnl`	Hydrogen Bonding, Electrostatic Potential, and Molecular Design. J. Chem. Inf. Model. Peter W. Kenny
1994	J	`jnl`	Pharmacophoric pattern matching in files of three-dimensional chemical structures: Comparison of conformational-searching algorithms for flexible searching. J. Chem. Inf. Comput. Sci. David E. Clark, Gareth Jones, Peter Willett, Peter W. Kenny, Robert C. Glen