Molecular dynamics simulations of the interactions of DMSO, mono- and polyhydroxylated cryosolvents with a hydrated phospholipid bilayer
Molecular dynamics (MD) simulations have been used to investigate the interactions of a variety of hydroxylated cryosolvents (glycerol, propylene glycol and ethylene glycol), methanol and dimethyl sulfoxide (DMSO) in aqueous solution with a 1,2-dipalmitoyl-sn-glycero-3-phosphatidylcholine (DPPC) bil...
| Main Authors: | Malajczuk, Chris, Hughes, Zak, Mancera, Ricardo |
|---|---|
| Format: | Journal Article |
| Published: |
Elsevier
2013
|
| Online Access: | http://hdl.handle.net/20.500.11937/18488 |
Similar Items
The effects of cryosolvents on DOPC-ß-sitosterol bilayers determined from molecular dynamics simulations
by: Hughes, Zak, et al.
Published: (2013)
by: Hughes, Zak, et al.
Published: (2013)
Molecular dynamics simulations of the interactions of DMSO with DPPC and DOPC phospholipid membranes
by: Hughes, Zak, et al.
Published: (2012)
by: Hughes, Zak, et al.
Published: (2012)
Molecular dynamics simulations of mixed DOPC-ß-sitosterol bilayers and their interactions with DMSO
by: Hughes, Zak, et al.
Published: (2013)
by: Hughes, Zak, et al.
Published: (2013)
Molecular mechanism of the synergistic effects of vitrification solutions on the stability of phospholipid bilayers
by: Hughes, Z., et al.
Published: (2014)
by: Hughes, Z., et al.
Published: (2014)
Influence of Bilayer Size and Number in Multi-Bilayer DOPC Simulations at Full and Low Hydration
by: Stachura, S., et al.
Published: (2019)
by: Stachura, S., et al.
Published: (2019)
Molecular dynamics simulations of a DMSO/water mixture using the AMBER force field
by: Stachura, S., et al.
Published: (2018)
by: Stachura, S., et al.
Published: (2018)
Molecular mechanism of solvent cryoprotection in aqueous DMSO solutions
by: Mandumpal, Jestin, et al.
Published: (2011)
by: Mandumpal, Jestin, et al.
Published: (2011)
Synthesis of polyhydroxylated flavonoids
by: Ahmad, Farediah, et al.
Published: (2009)
by: Ahmad, Farediah, et al.
Published: (2009)
Molecular modeling of hydration in drug design
by: Mancera, Ricardo
Published: (2007)
by: Mancera, Ricardo
Published: (2007)
The effect of H3O+ on the membrane morphology and hydrogen bonding of a phospholipid bilayer
by: Deplazes, Evelyne, et al.
Published: (2018)
by: Deplazes, Evelyne, et al.
Published: (2018)
Molecular Dynamics Visualization (MDV): Stereoscopic 3D Display of Biomolecular Structure and Interactions Using the Unity Game Engine
by: Wiebrands, Michael, et al.
Published: (2018)
by: Wiebrands, Michael, et al.
Published: (2018)
Molecular dynamics simulations of the interactions of potential foulant molecules and a reverse osmosis membrane
by: Hughes, Zak, et al.
Published: (2011)
by: Hughes, Zak, et al.
Published: (2011)
The molecular binding interactions of inhibitors and activators of phosphoenolpyruvate carboxylase
by: Mancera, Ricardo, et al.
Published: (2005)
by: Mancera, Ricardo, et al.
Published: (2005)
Computer simulations of glycolipid bilayers under anhydrous and hydrated conditions / M.Vijayan Manickam Achari
by: M.Vijayan , Manickam Achari
Published: (2016)
by: M.Vijayan , Manickam Achari
Published: (2016)
Prediction of the hydrate forming condition of natural gases in the presence of mono-ethylene glycol
by: Bahadori, Alireza, et al.
Published: (2009)
by: Bahadori, Alireza, et al.
Published: (2009)
Molecular dynamics simulations of CXCL-8 and its interactions with a receptor peptide, heparin fragments and sulfated cyclitols.
by: Gandhi, Neha, et al.
Published: (2011)
by: Gandhi, Neha, et al.
Published: (2011)
The structure and dynamics of plasma high-density lipoproteins and their interactions with the beta-amyloid peptide
by: Malajczuk, Chris
Published: (2022)
by: Malajczuk, Chris
Published: (2022)
The role of mitochondrial survivin in phospholipid biosynthesis
by: Dunajova, Lucia
Published: (2016)
by: Dunajova, Lucia
Published: (2016)
Gas Hydrates Investigations of Natural Gas with High Methane Content and Regenerated Mono-Ethylene Glycol
by: Al Harooni, Khalifa Mohamed Ali
Published: (2017)
by: Al Harooni, Khalifa Mohamed Ali
Published: (2017)
Interactions of the EGFR juxtamembrane domain with PIP2-containing lipid bilayers: insights from multiscale molecular dynamics simulations
by: Abd Halim, Khairul Bariyyah, et al.
Published: (2015)
by: Abd Halim, Khairul Bariyyah, et al.
Published: (2015)
The effect of hydronium ions on the structure of phospholipid membranes
by: Deplazes, Evelyne, et al.
Published: (2017)
by: Deplazes, Evelyne, et al.
Published: (2017)
Crystallisation of lactose monohydrate from DMSO solutions: Influence of lactose
by: Dincer, Tuna, et al.
Published: (1999)
by: Dincer, Tuna, et al.
Published: (1999)
Activation of DMSO for Swern-type oxidation by 1,1-dichlorocycloheptatriene
by: Nguyen, Thanh Vinh, et al.
Published: (2014)
by: Nguyen, Thanh Vinh, et al.
Published: (2014)
Structural and proteomic insights into the antibiofilm efficacy of DMSO on Corynebacterium pseudotuberculosis
by: Syaida, Anati Abd Rashid, et al.
Published: (2025)
by: Syaida, Anati Abd Rashid, et al.
Published: (2025)
Platelet endothelial cell adhesion molecule (PECAM-1) and its interactions with glycosaminoglycans 1. Molecular modelling studies
by: Gandhi, Neha, et al.
Published: (2008)
by: Gandhi, Neha, et al.
Published: (2008)
Characterization of the Glass Transition of Water Predicted by Molecular Dynamics Simulations Using Nonpolarizable Intermolecular Potentials
by: Kreck, Cara, et al.
Published: (2014)
by: Kreck, Cara, et al.
Published: (2014)
The Structure of Glycosaminoglycans and their Interactions with Proteins
by: Gandhi, Neha, et al.
Published: (2008)
by: Gandhi, Neha, et al.
Published: (2008)
Molecular and supramolecular chemistry of mono- and di-selenium analogues of metal dithiocarbamates
by: Lee, See Mun *, et al.
Published: (2018)
by: Lee, See Mun *, et al.
Published: (2018)
Dietary Phospholipids Requirement for Beluga Sturgeon (Huso huso) Juveniles
by: Ebrahimnezhadarabi, Mahmoudreza
Published: (2010)
by: Ebrahimnezhadarabi, Mahmoudreza
Published: (2010)
Ultrasound-Assisted Extraction of Phospholipids from Palm-Pressed Fiber
by: Chua, Seong Chea
Published: (2009)
by: Chua, Seong Chea
Published: (2009)
Free energy calculations of glycosaminoglycan-protein interactions
by: Gandhi, Neha, et al.
Published: (2009)
by: Gandhi, Neha, et al.
Published: (2009)
Molecular dynamics simulations of ligand-induced backbone conformational changes in the binding site of the periplasmic lysine-, arginine-, ornithine-binding protein
by: Yang, A., et al.
Published: (2008)
by: Yang, A., et al.
Published: (2008)
Prediction of the glass transition in aqueous solutions of simple amides by molecular dynamics simulations
by: Kreck, Cara, et al.
Published: (2011)
by: Kreck, Cara, et al.
Published: (2011)
Hydration, Hydration, Hydration
by: Miller, Veronica, et al.
Published: (2010)
by: Miller, Veronica, et al.
Published: (2010)
Can current force fields reproduce ring puckering in 2-O-sulfo-?-L-iduronic acid? A molecular dynamics simulation study
by: Gandhi, Neha, et al.
Published: (2010)
by: Gandhi, Neha, et al.
Published: (2010)
Effects of exposure to dmso in vitrification solution on cytotoxicity and in vitro viability of immature bovine oocyte.
by: H., Hajarian, et al.
Published: (2010)
by: H., Hajarian, et al.
Published: (2010)
Molecular dynamics simulation of the phosphorylation-induced conformational changes of a tau peptide fragment
by: Lyons, Albert, et al.
Published: (2014)
by: Lyons, Albert, et al.
Published: (2014)
Computational Methods for the Prediction of the Structure and Interactions of Coiled-Coil Peptides
by: Gandhi, Neha, et al.
Published: (2008)
by: Gandhi, Neha, et al.
Published: (2008)
Optimization of ultrasound extraction condition of phospholipids from palm-pressed fiber.
by: Chua, Seong Chea, et al.
Published: (2009)
by: Chua, Seong Chea, et al.
Published: (2009)
Pegylated Phospholipid Nanomicelles Containing Budesonide Or Beclimethasone Dipropionate For Pulmonary Delivery
by: Sahib, Mohanad Naji
Published: (2011)
by: Sahib, Mohanad Naji
Published: (2011)
Similar Items
-
The effects of cryosolvents on DOPC-ß-sitosterol bilayers determined from molecular dynamics simulations
by: Hughes, Zak, et al.
Published: (2013) -
Molecular dynamics simulations of the interactions of DMSO with DPPC and DOPC phospholipid membranes
by: Hughes, Zak, et al.
Published: (2012) -
Molecular dynamics simulations of mixed DOPC-ß-sitosterol bilayers and their interactions with DMSO
by: Hughes, Zak, et al.
Published: (2013) -
Molecular mechanism of the synergistic effects of vitrification solutions on the stability of phospholipid bilayers
by: Hughes, Z., et al.
Published: (2014) -
Influence of Bilayer Size and Number in Multi-Bilayer DOPC Simulations at Full and Low Hydration
by: Stachura, S., et al.
Published: (2019)