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Chimia|July 8, 2021
Taste Perception: Molecular Recognition of Food MoleculesYvonne Westermaier
Journal of Computer-Aided Molecular Design|July 5, 2019
Extensive benchmark of rDock as a peptide-protein docking toolDaniel Soler, Yvonne Westermaier, Robert Soliva
Methods (San Diego, Calif.)|September 7, 2014
Virtual screening: an in silico tool for interlacing the chemical universe with the proteomeYvonne Westermaier, Xavier Barril, Leonardo Scapozza
Pharmaceutical Research|February 16, 2013
Breaking the aggregation of the monoclonal antibody bevacizumab (avastin®) by dexamethasone phosphate: insights from molecular modelling and asymmetrical flow field-flow fractionationMarieke Veurink, Yvonne Westermaier, Robert Gurny, et al.
Journal of Chemical Information and Modeling|May 20, 2025
The Quasi-Bound State as a Predictor of Relative Binding Free EnergyÁlvaro Serrano-Morrás, Yvonne Westermaier, Maciej Majewski, et al.
PNAS Nexus|November 20, 2025
Molecular simulations meet personalized medicine: The mechanism of action of CLC-5 antiporter and the origin of Dent's diseaseVeronica Macaluso, Carles Pérez, Robert Soliva, et al.
Nucleosides, Nucleotides & Nucleic Acids|May 31, 2011
Synthesis, crystal structure, and in vitro biological evaluation of C-6 pyrimidine derivatives: new lead structures for monitoring gene expression in vivoMiljen Martić, Lucile Pernot, Yvonne Westermaier, et al.
Journal of Computer-Aided Molecular Design|July 17, 2017
Binding mode prediction and MD/MMPBSA-based free energy ranking for agonists of REV-ERBα/NCoRYvonne Westermaier, Sergio Ruiz-Carmona, Isabelle Theret, et al.
Frontiers in Molecular Biosciences|April 28, 2022
Building Biological Relevance Into Integrative Modelling of Macromolecular AssembliesAnne-Elisabeth Molza, Yvonne Westermaier, Magali Moutte, et al.
Bioorganic & Medicinal Chemistry Letters|September 14, 2011
A new N-methyl thymine derivative comprising a dihydroxyisobutenyl unit as ligand for thymidine kinase of herpes simplex virus type 1 (HSV-1 TK)Svjetlana Krištafor, Ivana Novaković, Tatjana Gazivoda Kraljević, et al.
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