Mechanistic understanding from molecular dynamics simulation in pharmaceutical research 1: drug delivery
In this review, we outline the growing role that molecular dynamics simulation is able to play
as a design tool in drug delivery. We cover both the pharmaceutical and computational …
as a design tool in drug delivery. We cover both the pharmaceutical and computational …
[HTML][HTML] Rational design of liposomal drug delivery systems, a review: Combined experimental and computational studies of lipid membranes, liposomes and their …
Combined experimental and computational studies of lipid membranes and liposomes, with
the aim to attain mechanistic understanding, result in a synergy that makes possible the …
the aim to attain mechanistic understanding, result in a synergy that makes possible the …
[HTML][HTML] Computational and experimental approaches for investigating nanoparticle-based drug delivery systems
Most therapeutic agents suffer from poor solubility, rapid clearance from the blood stream, a
lack of targeting, and often poor translocation ability across cell membranes. Drug/gene …
lack of targeting, and often poor translocation ability across cell membranes. Drug/gene …
Mechanistic understanding from molecular dynamics in pharmaceutical research 2: lipid membrane in drug design
We review the use of molecular dynamics (MD) simulation as a drug design tool in the
context of the role that the lipid membrane can play in drug action, ie, the interaction …
context of the role that the lipid membrane can play in drug action, ie, the interaction …
Indocyanine green-loaded liposomes for light-triggered drug release
Light-triggered drug delivery systems enable site-specific and time-controlled drug release.
In previous work, we have achieved this with liposomes containing gold nanoparticles in the …
In previous work, we have achieved this with liposomes containing gold nanoparticles in the …
Surface bioengineering of diatomite based nanovectors for efficient intracellular uptake and drug delivery
Diatomite is a natural porous silica material of sedimentary origin. Due to its peculiar
properties, it can be considered as a valid surrogate of synthetic porous silica for nano …
properties, it can be considered as a valid surrogate of synthetic porous silica for nano …
[HTML][HTML] Gold nanocage-photosensitizer conjugates for dual-modal image-guided enhanced photodynamic therapy
We have demonstrated that gold nanocage-photosensitizer conjugates can enable dual
image-guided delivery of photosensitizer and significantly improve the efficacy of …
image-guided delivery of photosensitizer and significantly improve the efficacy of …
Prodrug strategies for paclitaxel
Paclitaxel is an anti-tumor agent with remarkable anti-tumor activity and wide clinical uses.
However, it is also faced with various challenges especially for its poor water solubility and …
However, it is also faced with various challenges especially for its poor water solubility and …
MgO nanoparticles coated with polyethylene glycol as carrier for 2-Methoxyestradiol anticancer drug
Novel Magnesium Oxide (MgO) nanoparticles (NPs) modified with the polymer polyethylene
glycol (PEG) were synthesized as carrier for the anticancer drug 2-Methoxyestradiol (2ME) …
glycol (PEG) were synthesized as carrier for the anticancer drug 2-Methoxyestradiol (2ME) …
Poly (ethylene glycol) in drug delivery, why does it work, and can we do better? All atom molecular dynamics simulation provides some answers
A Bunker - Physics procedia, 2012 - Elsevier
We summarize our recent work, using all atom molecular dynamics simulation to study the
role of poly (ethylene glycol)(PEG) in drug delivery. We have simulated the drug delivery …
role of poly (ethylene glycol)(PEG) in drug delivery. We have simulated the drug delivery …