Molecular dynamics simulations of cRGD-conjugated PEGylated TiO

Autor:	Paulo, Siani, Giulia, Frigerio, Edoardo, Donadoni, Cristiana, Di Valentin
Rok vydání:	2022
Předmět:	Titanium Photochemotherapy Cell Line Tumor Integrin beta3 Nanoparticles Water Molecular Dynamics Simulation Integrin alphaVbeta3 Ligands Peptides Cyclic Polyethylene Glycols
Zdroj:	Journal of colloid and interface science. 627
ISSN:	1095-7103
Popis:	The conjugation of high-affinity cRGD-containing peptides is a promising approach in nanomedicine to efficiently reduce off-targeting effects and enhance the cellular uptake by integrin-overexpressing tumor cells. Herein we utilize atomistic molecular dynamics simulations to evaluate key structural-functional parameters of these targeting ligands for an effective binding activity towards α
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=pmid________::794cf0cab713a7425129055777245916 https://pubmed.ncbi.nlm.nih.gov/35842963 Zobrazit plný text záznamu Full Text from ScienceDirect