| Consensus queries in ligand-based virtual screening experiments F Berenger, O Vu, J Meiler Journal of cheminformatics 9, 1-13, 2017 | 18 | 2017 |
| Interpretable chirality-aware graph neural network for quantitative structure activity relationship modeling in drug discovery YL Liu, Y Wang, O Vu, R Moretti, B Bodenheimer, J Meiler, T Derr Proceedings of the AAAI Conference on Artificial Intelligence 37 (12), 14356 …, 2023 | 13 | 2023 |
| Highly Selective Y4 Receptor Antagonist Binds in an Allosteric Binding Pocket C Schüß, O Vu, M Schubert, Y Du, NM Mishra, IR Tough, J Stichel, ... Journal of Medicinal Chemistry 64 (5), 2801-2814, 2021 | 13 | 2021 |
| Introduction to the BioChemical Library (BCL): An application-based open-source toolkit for integrated cheminformatics and machine learning in computer-aided drug discovery BP Brown, O Vu, AR Geanes, S Kothiwale, M Butkiewicz, EW Lowe Jr, ... Frontiers in pharmacology 13, 833099, 2022 | 12 | 2022 |
| The structural basis of peptide binding at class AG protein-coupled receptors O Vu, BJ Bender, L Pankewitz, D Huster, AG Beck-Sickinger, J Meiler Molecules 27 (1), 210, 2021 | 10 | 2021 |
| BCL:: Mol2D—a robust atom environment descriptor for QSAR modeling and lead optimization O Vu, J Mendenhall, D Altarawy, J Meiler Journal of computer-aided molecular design 33, 477-486, 2019 | 7 | 2019 |
| Structural perspective on ancient neuropeptide Y-like system reveals Hallmark features for peptide recognition and receptor activation MM Gershkovich, VE Groß, O Vu, CT Schoeder, J Meiler, S Prömel, ... Journal of molecular biology 433 (13), 166992, 2021 | 6 | 2021 |
| Binding of Natural Peptide Ligands to the Neuropeptide Y5 Receptor S Rudolf, K Kaempf, O Vu, J Meiler, AG Beck‐Sickinger, I Coin Angewandte Chemie International Edition 61 (5), e202108738, 2022 | 5 | 2022 |
| Structure–Activity Relationship Study of the High-Affinity Neuropeptide Y4 Receptor Positive Allosteric Modulator VU0506013 C Schüß, O Vu, NM Mishra, IR Tough, Y Du, J Stichel, HM Cox, ... Journal of Medicinal Chemistry 66 (13), 8745-8766, 2023 | 2 | 2023 |
| Mapping the binding sites of UDP and prostaglandin E2 glyceryl ester in the nucleotide receptor P2Y6 A Zimmermann, O Vu, A Brüser, G Sliwoski, LJ Marnett, J Meiler, ... ChemMedChem, 2022 | 2 | 2022 |
| Discovery and Characterization of Y4R Allosteric Modulators Using Computer-Aided Drug Design OTN Vu | | 2022 |
| Tutorial 8: Rapid generation of non-canonical amino acid (NCAA) params for Rosetta with BCL O Vu, BP Brown | | 2022 |
| Asymmetric syntheses identify preferred stereochemistry in small molecule allosteric modulators of the neuropeptide Y4 receptor M Schubert, O Vu, Y Du, J Stichel, C Schüß, CD Weaver, ... | | 2019 |
Jens MeilerVanderbilt University & University LeipzigVerified email at meilerlab.org
