Deliberations and Considerations of Mesodyn Simulations in Pharmaceuticals

Pp: 227-248 (22)

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Abstract

The main aim of this chapter is the detailed analysis of the Mesodyn module and how it is beneficial in the pharmaceuticals or drug delivery systems. These models are the generalization of a coarse-grained model in mesoscopic dynamics which is used for the field-based simulations of complex systems. A set of functional Langevin equations characterize the system’s behavior. These computer-based simulation tools have been proven effective for providing information at molecular and mesoscopic scales and also for overcoming the limitations of wet lab experiments. So, this chapter will discuss the potential use of Mesodyn simulations in pre-formulations and various other applications for the rational designing of drug delivery systems after providing a brief theoretical background.

Keywords: Coarse-grained model, Drug delivery, Formulation, Investigations, Material studio, Molecular dynamics, Mesodyn, Pharmaceutics, Simulations.