30–31 Oct 2025
IT4Innovations
Europe/Prague timezone

Atomistic Insights into the Structure and Dynamics of Lipid Nanoparticles

30 Oct 2025, 18:25
1m
atrium (IT4Innovations)

atrium

IT4Innovations

Studentská 6231/1B 708 00 Ostrava-Poruba
Poster Materials Science (e.g. Computational/Theoretical/Physical Chemistry, Soft Matter, Polymer Research) Conference Dinner and Poster Session

Speaker

Adéla Chadalíková (CATRIN, VŠB-TUO)

Description

Lipid nanoparticles (LNPs) are widely used as drug delivery systems and have been successfully applied in vaccines such as Onpattro, Comirnaty, and Spikevax. Despite their global success, key questions remain regarding the mechanisms of endosomal drug release from LNPs. Numerous experimental and theoretical studies have addressed this topic. Most previous theoretical studies have been performed at a coarse-grained resolution. My work aims to develop an atomistic simulation protocol to gradually construct inverse hexagonal lipid assemblies containing RNA molecules at their core. The structural and dynamic properties of these systems would be analyzed and compared with experimental data. This inverse hexagonal organization is hypothesized to play a critical role in facilitating endosomal escape, and understanding its behavior may provide valuable insights into improving LNP-based drug delivery.

Primary authors

Adéla Chadalíková (CATRIN, VŠB-TUO) Markéta Paloncýová (Regional Centre of Advanced Technologies and Materials, Czech Advanced Technology and Research Institute (CATRIN), Palacký University Olomouc) Michal Otyepka Petra Kührová (Regional Center of Advanced Technologies and Materials, The Czech Advanced Technology and Research Institute, Palacký University Olomouc)

Presentation materials

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