Mechanistic Insight into How PEGylation Reduces the Efficacy of pH-Sensitive Liposomes from Molecular Dynamics Simulations

Mohammad Mahmoudzadeh; Aniket Magarkar; Artturi Koivuniemi; Tomasz Róg; Alex Bunker

doi:10.1021/acs.molpharmaceut.1c00122

Mechanistic Insight into How PEGylation Reduces the Efficacy of pH-Sensitive Liposomes from Molecular Dynamics Simulations

Mohammad Mahmoudzadeh, Aniket Magarkar, Artturi Koivuniemi, Tomasz Róg, Alex Bunker

Research output: Contribution to journal › Article › Scientific › peer-review

Original language	English
Journal	Molecular Pharmaceutics
Volume	18
Issue number	7
Pages (from-to)	2612-2621
Number of pages	10
ISSN	1543-8384
DOIs	https://doi.org/10.1021/acs.molpharmaceut.1c00122
Publication status	Published - 5 Jul 2021
MoE publication type	A1 Journal article-refereed

Fields of Science

ATOM FORCE-FIELD
DRUG-DELIVERY
EFFECTIVE INCLUSION
HEXAGONAL PHASE
INDUCED DESTABILIZATION
LIPID-BILAYERS
PARTICLE MESH EWALD
PEGylated pH-sensitive liposomes
PHASE-TRANSITION
POTENTIAL FUNCTIONS
TRIGGERED RELEASE
bilayer hydrophilicity
cholesteryl hemisuccinate
molecular dynamics simulations
phase transition
317 Pharmacy

Access to Document

10.1021/acs.molpharmaceut.1c00122

Mahmoudzadeh_et_al_manuscriptAccepted author manuscript, 2.15 MB
acs.molpharmaceut.1c00122Final published version, 2.59 MBLicence: CC BY

Cite this

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title = "Mechanistic Insight into How PEGylation Reduces the Efficacy of pH-Sensitive Liposomes from Molecular Dynamics Simulations",

keywords = "ATOM FORCE-FIELD, DRUG-DELIVERY, EFFECTIVE INCLUSION, HEXAGONAL PHASE, INDUCED DESTABILIZATION, LIPID-BILAYERS, PARTICLE MESH EWALD, PEGylated pH-sensitive liposomes, PHASE-TRANSITION, POTENTIAL FUNCTIONS, TRIGGERED RELEASE, bilayer hydrophilicity, cholesteryl hemisuccinate, molecular dynamics simulations, phase transition, 317 Pharmacy",

author = "Mohammad Mahmoudzadeh and Aniket Magarkar and Artturi Koivuniemi and Tomasz R{\'o}g and Alex Bunker",

year = "2021",

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day = "5",

doi = "10.1021/acs.molpharmaceut.1c00122",

language = "English",

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T1 - Mechanistic Insight into How PEGylation Reduces the Efficacy of pH-Sensitive Liposomes from Molecular Dynamics Simulations

AU - Mahmoudzadeh, Mohammad

AU - Magarkar, Aniket

AU - Koivuniemi, Artturi

AU - Róg, Tomasz

AU - Bunker, Alex

PY - 2021/7/5

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KW - DRUG-DELIVERY

KW - EFFECTIVE INCLUSION

KW - HEXAGONAL PHASE

KW - INDUCED DESTABILIZATION

KW - LIPID-BILAYERS

KW - PARTICLE MESH EWALD

KW - PEGylated pH-sensitive liposomes

KW - PHASE-TRANSITION

KW - POTENTIAL FUNCTIONS

KW - TRIGGERED RELEASE

KW - bilayer hydrophilicity

KW - cholesteryl hemisuccinate

KW - molecular dynamics simulations

KW - phase transition

KW - 317 Pharmacy

U2 - 10.1021/acs.molpharmaceut.1c00122

DO - 10.1021/acs.molpharmaceut.1c00122

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VL - 18

SP - 2612

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JO - Molecular Pharmaceutics

JF - Molecular Pharmaceutics

SN - 1543-8384

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ER -