Currently, the understanding of LNP structure and organization is limited, primarily based on experimental techniques such as Small-Angle X-ray, Neutron Scattering (SAXS, SANS) and low-resolution Cryo-Transmission Electron Microscopy data . While these methods provide valuable insights, they often lack the resolution needed to fully elucidate the complex architecture of LNPs. Simulation studies attempting to model and further understand LNP organization have also been limited . These studies typically focus on smaller bilayer patches or particles, examining how pH variations affect lipid packing and distribution. Notably, only one successful study has simulated the transfection of DNA cargo from a lipoplex .