Because they can function like biological processes and increase the efficacy of treatments, bioinspired nanocarriers seem like promising candidates for novel drug transport systems. Made to seem like or integrate biological components including lipids, proteins, and peptides, Nano carriers’ better biocompatibility, targeted distribution, and controlled release profiles are among its various advantages over conventional drug delivery methods. Design, enhancement, and testing of bioinspired nanocarriers depend much on the computational point of view. It allows scientists to project their behaviour and optimal utilisation of interactions with medications and biological systems. Many computational techniques including molecular dynamics simulations, density functional theory (DFT), and Monte Carlo simulations are applied to explain interactions between organic molecules and nanocarriers. These investigations clarify structural stability of stable nanocarriers, pharmacological release of pharmaceuticals, and bioavailability of them. Furthermore, computer simulations simplify the assumption of how these systems might operate concerning immunity, toxicity, and metabolism. Safety and efficacy criteria can thus be satisfied prior to their entering clinical trials. A bioinspired approach to nanocarrier design emphasises the need of molecules' ability to identify one another, therefore enabling focused treatment of certain cells or tissues. These nanocarriers may be created to pass beyond biological barriers and convey pharmaceuticals straight to where they are required by mimicking the way proteins naturally behave that is, how receptors and ligands interact or how cells absorb them. Computer-based techniques also enable us to investigate novel materials and surface modifications that could stabilise medicinal compounds, boost their loading capacity, and enable regulated release. It discusses how computer algorithms help to produce bioinspired nanocarriers carrying pharmaceuticals. .
Keywords: Bioinspired nanocarriers, Drug delivery systems, Molecular dynamics simulations, Targeted delivery, Computational modeling.
How to cite this article: Shewale M, Pareek RK, Jadhav R, Ambhore V, Bhat MA, Bioinspired Nanocarriers for Drug Delivery: A Computational Perspective .Int J Drug Deliv Technol. 2026;16(1s): 50-57; DOI: 10.25258/ijddt.16. 50-57