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Journal of Molecular Modeling|January 4, 2008
Multiple-step virtual screening using VSM-G: overview and validation of fast geometrical matching enrichmentAlexandre Beautrait, Vincent Leroux, Matthieu Chavent, et al.Journal of Chemical Information and Modeling|May 11, 2023
Enhancing Hit Discovery in Virtual Screening through Absolute Protein-Ligand Binding Free-Energy CalculationsWei Chen, Di Cui, Steven V Jerome, et al.Scientific Reports|April 4, 2019
Identification of Allosteric Inhibitors against Active Caspase-6Agne Tubeleviciute-Aydin, Alexandre Beautrait, Jeffrey Lynham, et al.ACS Bio & Med Chem Au|December 25, 2023
Shape-Based Virtual Screening of a Billion-Compound Library Identifies Mycobacterial Lipoamide Dehydrogenase InhibitorsMayako Michino, Alexandre Beautrait, Nicholas A Boyles, et al.Cellular and Molecular Life Sciences : CMLS|February 11, 2020
Beta-arrestins operate an on/off control switch for focal adhesion kinase activityRevu Ann Alexander, Isaure Lot, Kusumika Saha, et al.The Journal of Biological Chemistry|July 23, 2014
Mapping the putative G protein-coupled receptor (GPCR) docking site on GPCR kinase 2: insights from intact cell phosphorylation and recruitment assaysAlexandre Beautrait, Kevin R Michalski, Thomas S Lopez, et al.Nature Communications|April 19, 2017
A new inhibitor of the β-arrestin/AP2 endocytic complex reveals interplay between GPCR internalization and signallingAlexandre Beautrait, Justine S Paradis, Brandon Zimmerman, et al.Nature Communications|August 4, 2021
Discovery of a dual Ras and ARF6 inhibitor from a GPCR endocytosis screenJenna Giubilaro, Doris A Schuetz, Tomasz M Stepniewski, et al.ACS Medicinal Chemistry Letters|May 20, 2026
Targeting the H/KRAS α4-β6-α5 Allosteric Lobe with Macrocyclic PeptidesKien Tran, Hugo Lavoie, Amal Wahhab, et al.Journal of Medicinal Chemistry|December 12, 2025
Unique Interactions of Novel Rufomycin "Click Chemistry" Analogs with <i>Mtb</i> ClpC1 and ImplicationsKiira Ratia, Shengnan Jin, Celerino Abad-Zapatero, et al.Pageof 2