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Emerging applications of polymersomes in delivery: from molecular dynamics to shrinkage of tumors
Polymersomes are self-assembled shells of amphiphilic block copolymers that are currently
being developed by many groups for fundamental insights into the nature of self-assembled …
being developed by many groups for fundamental insights into the nature of self-assembled …
[HTML][HTML] Molecular simulations of PEGylated biomolecules, liposomes, and nanoparticles for drug delivery applications
H Lee - Pharmaceutics, 2020 - mdpi.com
Since the first polyethylene glycol (PEG) ylated protein was approved by the FDA in 1990,
PEGylation has been successfully applied to develop drug delivery systems through …
PEGylation has been successfully applied to develop drug delivery systems through …
MARTINI coarse-grained models of polyethylene and polypropylene
The understanding of the interaction of nanoplastics with living organisms is crucial both to
assess the health hazards of degraded plastics and to design functional polymer …
assess the health hazards of degraded plastics and to design functional polymer …
Coarse-grained model for PEGylated lipids: effect of PEGylation on the size and shape of self-assembled structures
Self-assembly of polyethylene glycol (PEG)-grafted lipids at different sizes and
concentrations was simulated using the MARTINI coarse-grained (CG) force field. The …
concentrations was simulated using the MARTINI coarse-grained (CG) force field. The …
Predicting the solubility of the anti-cancer agent docetaxel in small molecule excipients using computational methods
Purpose To develop an in silico model that provides an accurate prediction of the relative
solubility of the lipophilic anticancer agent docetaxel in various excipients. Materials and …
solubility of the lipophilic anticancer agent docetaxel in various excipients. Materials and …
PEO-b-PBD Diblock Copolymers Induce Packing Defects in Lipid/Hybrid Membranes and Improve Insertion Rates of Natively Folded Peptides
Hybrid membranes assembled from biological lipids and synthetic polymers are a promising
scaffold for the reconstitution and utilization of membrane proteins. Recent observations …
scaffold for the reconstitution and utilization of membrane proteins. Recent observations …
Interactions of PEO–PPO–PEO block copolymers with lipid membranes: a computational and experimental study linking membrane lysis with polymer structure
Poly (ethylene oxide)(PEO) and poly (propylene oxide)(PPO) block co-polymers (PEO–PPO–
PEO, sold as Pluronics, Poloxamers, Tetronics) are a widely used class of amphiphilic …
PEO, sold as Pluronics, Poloxamers, Tetronics) are a widely used class of amphiphilic …
Absorption of Polypropylene in Dipalmitoylphosphatidylcholine Membranes: The Role of Molecular Weight and Initial Configuration of Polymer Chains
We study by molecular dynamics simulations the absorption of polypropylene (PP) chains
within a dipalmitoylphosphatidylcholine (DPPC) lipid membrane in aqueous solvent. DPPC …
within a dipalmitoylphosphatidylcholine (DPPC) lipid membrane in aqueous solvent. DPPC …
Modeling the effect of nano-sized polymer particles on the properties of lipid membranes
The interaction between polymers and biological membranes has recently gained significant
interest in several research areas. On the biomedical side, dendrimers, linear …
interest in several research areas. On the biomedical side, dendrimers, linear …
Simulating the interaction of lipid membranes with polymer and ligand-coated nanoparticles
Nanoscience and nanotechnology are undergoing rapid expansion owing to the promise of
breakthroughs in key sectors, such as energy and medicine. As for medicine, interaction of …
breakthroughs in key sectors, such as energy and medicine. As for medicine, interaction of …