2016
DOI: 10.3390/bios6020025
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Optimal Magnetic Field for Crossing Super-Para-Magnetic Nanoparticles through the Brain Blood Barrier: A Computational Approach

Abstract: This paper scrutinizes the magnetic field effect to deliver the superparamagnetic nanoparticles (SPMNs) through the Blood Brain Barrier (BBB). Herein we study the interaction between the nanoparticle (NP) and BBB membrane using Molecular Dynamic (MD) techniques. The MD model is used to enhance our understanding of the dynamic behavior of SPMNs crossing the endothelial cells in the presence of a gradient magnetic field. Actuation of NPs under weak magnetic field offers the great advantage of a non-invasive drug… Show more

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Cited by 44 publications
(18 citation statements)
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“…The results reveal that dopamine binds preferentially to octahedral sites and that the linking bond is with covalent nature. Experimental data corroborate the results, and the agreement proves that the DFT simulations can serve as an appropriate supplemental approach to interpreting 57 Fe Mössbauer spectra of SPIONs.…”
Section: Experimental Results Of S Kumar Et Al Show a Different Stasupporting
confidence: 75%
See 1 more Smart Citation
“…The results reveal that dopamine binds preferentially to octahedral sites and that the linking bond is with covalent nature. Experimental data corroborate the results, and the agreement proves that the DFT simulations can serve as an appropriate supplemental approach to interpreting 57 Fe Mössbauer spectra of SPIONs.…”
Section: Experimental Results Of S Kumar Et Al Show a Different Stasupporting
confidence: 75%
“…Recently, M. Z. Pedram et al explored the magnetic field effect to deliver SPIONs through the blood-brain barrier using molecular dynamics simulations and CHARMM27 force field [57]. The solvent effects were also taken into account by using the TIP3P method for water.…”
Section: Computational Investigations Of Spionsmentioning
confidence: 99%
“…The selected literature about magnetic targeting/delivery in the CNS was classified into seven main groups: reviews [ 4 , 5 , 6 , 7 , 8 , 9 , 10 , 11 , 12 , 13 , 14 , 15 , 16 , 17 , 18 , 19 , 20 , 21 ]; in silico modeling [ 22 , 23 , 24 , 25 ]; BBB crossing under Static Magnetic Field (SMF) influence [ 26 , 27 , 28 , 29 , 30 , 31 , 32 , 33 , 34 , 35 , 36 , 37 ]; Alternating Magnetic Field (AMF) applications for targeting/delivery [ 38 , 39 , 40 , 41 , 42 , 43 ]; magnetofection [ 44 , 45 , 46 , 47 , 48 , 49 ]; applications for CNS ...…”
Section: Resultsmentioning
confidence: 99%
“…Size, shape and coating can alter magnetic forces and resistance by orders of magnitude: exceedingly small particles experience an insufficient magnetic force and too big ones encounter too much resistance in the tissue [ 24 , 25 ]. In general, the field strength should be of the order of 200–700 mT with gradients of about 8–100 T/m, depending on the blood flow (rate ranging from 10 cm/s in arteries to 0.05 cm/s in capillaries) [ 9 ].…”
Section: Discussionmentioning
confidence: 99%
“…Magnetic nanoparticles (MNPs) were notably highlighted [ 24 ] because of their intrinsic magnetic properties and remain very useful tools for non-invasive MRI. In addition, some MNPs have shown potential properties to overcome certain biological and physical barriers, such as the BBB [ 25 ], and have proved their usefulness with tissue repair and hyperthermia properties [ 26 ]. MNPs gather superparamagnetic iron oxide nanoparticles (SPIONS), NPs with a metallic core (cobalt, zinc, nickel …), and other nanoparticles coated with magnetic material (silica NPs coated by gadolinium chelates or with iron …) [ 27 ].…”
Section: Introductionmentioning
confidence: 99%