The role of multiscale computational approaches for rational design of conventional and nanoparticle oral drug delivery systems

摘要: Multiscale computational modeling of drug delivery systems (DDS) is poised to provide predictive capabilities for the rational design targeted systems, including multi-functional nanoparticles. Realistic, mechanistic models can a framework understanding fundamental physico-chemical interactions between drug, system, and patient. modeling, however, in its infancy even conventional delivery. The wide range emerging nanotechnology further increases need reliable silico predictions. This review will present existing approaches at different scales traditional oral systems. Subsequently, multiscale integrating continuum, stochastic, chemistry be proposed case study presented DDS. extension this discussed along with future directions. While focus review, outlined applied other as well.