[HTML][HTML] Simulation-based approaches for drug delivery systems: Navigating advancements, opportunities, and challenges

I Salahshoori, M Golriz, MAL Nobre, S Mahdavi… - Journal of Molecular …, 2024 - Elsevier
Efficient drug delivery systems (DDSs) play a pivotal role in ensuring pharmaceuticals'
targeted and effective administration. However, the intricate interplay between drug …

Theoretical studies of phosphorene as a drug delivery nanocarrier for fluorouracil

R Esfandiarpour, F Badalkhani-Khamseh… - RSC advances, 2023 - pubs.rsc.org
The interactions between phosphorene nanosheets (PNSs) and 5-fluorouracil (FLU) were
explored using the density functional theory (DFT) method and molecular dynamics (MD) …

Spherical PEG/SiO2 promising agents for Lamivudine antiviral drug delivery, a molecular dynamics simulation study

S Razzaghi, M Vafaee, B Kharazian… - Scientific Reports, 2023 - nature.com
Spherical nanocarriers can lead to a bright future to lessen problems of virus infected
people. Spherical polyethylene glycol (PEG) and spherical silica (SiO2) are novel attractive …