Oanh Vu

Introduction to the BioChemical Library (BCL): An Application-Based Open-Source Toolkit for Integrated Cheminformatics and Machine Learning in Computer-Aided Drug Discovery

Benjamin P. Brown, Oanh Vu, Alexander R. Geanes et al. · Frontiers in Pharmacology · 2022 · 24 citations · Full text

Drug Target, Hit Identification, Machine Learning +17

CACHE Challenge #1: Targeting the WDR Domain of LRRK2, A Parkinson’s Disease Associated Protein

Fengling Li, Suzanne Ackloo, C.H. Arrowsmith et al. · Journal of Chemical Information and Modeling · 2024 · 23 citations · Full text

Highly Selective Y₄ Receptor Antagonist Binds in an Allosteric Binding Pocket

Corinna Schüß, Oanh Vu, Mario Schubert et al. · Journal of Medicinal Chemistry · 2021 · 21 citations · Full text

Interpretable Chirality-Aware Graph Neural Network for Quantitative Structure Activity Relationship Modeling in Drug Discovery

Yunchao Liu, Yu Wang, Oanh Vu et al. · Proceedings of the AAAI Conference on Artificial Intelligence · 2023 · 21 citations · Full text

Graph Representation Learning, Machine Learning, Engineering +20

Consensus queries in ligand-based virtual screening experiments

Francois Berenger, Oanh Vu, Jens Meiler · Journal of Cheminformatics · 2017 · 16 citations · Full text