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Dissolution of variable-in-shape drug particles via the level-set method

Cristiani, Emiliano
•
Grassi, Mario
•
Ignoto, Francesca L.
•
Pontrelli, Giuseppe
2025
  • journal article

Periodico
APPLIED MATHEMATICAL MODELLING
Abstract
In this work, we deal with a mathematical model describing the dissolution process of irregularly shaped particles. In particular, we consider a complete dissolution model accounting for surface kinetics, convective diffusion, and relative velocity between fluid and dissolving particles, for three drugs with different solubility and wettability: theophylline, griseofulvin, and nimesulide. The possible subsequent recrystallization process in the bulk fluid is also considered. The governing differential equations are revisited in the context of the level-set method and Hamilton-Jacobi equations, then they are solved numerically. This choice allows us to deal with the simultaneous dissolution of hundreds of different polydisperse particles. We show the results of many computer simulations which investigate the impact of the particle size, shape, area/volume ratio, and the dependence of the interfacial mass transport coefficient on the surface curvature.
DOI
10.1016/j.apm.2025.115966
WOS
WOS:001414965100001
Archivio
https://hdl.handle.net/11368/3113755
info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85216207566
https://www.sciencedirect.com/science/article/pii/S0307904X25000411?via=ihub
Diritti
open access
license:creative commons
license uri:http://creativecommons.org/licenses/by-nc-nd/4.0/
FVG url
https://arts.units.it/bitstream/11368/3113755/1/Appl Math Mod 2025.pdf
Soggetti
  • Drug dissolution

  • Hamilton-Jacobi equat...

  • Level-set method

  • Mathematical modeling...

  • Recrystallization

  • Solubility

  • Variable shape partic...

  • Wettability

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