Virtual Screening and Prediction of Site of Metabolism for Cytochrome P450 1A2 Ligands. - Poongavanam Vasanthanathan; Jozef Hritz; Olivier Taboureau; Lars Olsen; Flemming Steen Jørgensen; Nico P. E. Vermeulen; Chris Oostenbrink (J. Chem. Inf. Model., 2009)

Ligand and Structure-Based Classification Models for Prediction of P-Glycoprotein Inhibitors. - Freya Klepsch; Poongavanam Vasanthanathan; Gerhard F. Ecker (J. Chem. Inf. Model., 2014)

Simulation Reveals the Chameleonic Behavior of Macrocycles. - Daniel Sethio; Poongavanam Vasanthanathan; Ruisheng Xiong; Mohit Tyagi; Duc Duy Vo; Roland Lindh; Jan Kihlberg (J. Chem. Inf. Model., 2023)