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[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 …
Strategies for enhancing ionic conductivity and energy density of gel polymer electrolytes for next-generation flexible energy storage devices
In energy storage devices, gel polymer electrolytes (GPE) are favorable choices of
electrolytes due to the absence of leakage, interchangeability with separators and increased …
electrolytes due to the absence of leakage, interchangeability with separators and increased …
Molecular dynamics simulation of thermal energy transport in polydimethylsiloxane
Heat transfer across thermal interface materials is a critical issue for microelectronics
thermal management. Polydimethylsiloxane (PDMS), one of the most important components …
thermal management. Polydimethylsiloxane (PDMS), one of the most important components …
Self-assembly of lysine-based dendritic surfactants modeled by the self-consistent field approach
Implementing a united atom model, we apply self-consistent field theory to study structure
and thermodynamic properties of spherical micelles composed of surfactants that combine …
and thermodynamic properties of spherical micelles composed of surfactants that combine …
Effect of an asymmetry of branching on structural characteristics of dendrimers revealed by Brownian dynamics simulations
Dendrimers in dilute solution with asymmetry of branching were simulated by the Brownian
dynamics method. In this simulation a coarse-grained dendrimer model and athermal …
dynamics method. In this simulation a coarse-grained dendrimer model and athermal …
Lysine dendrigraft nanocontainers. influence of topology on their size and internal structure
Poly-l-ysine dendrigrafts are promising systems for biomedical applications due to their
biodegradability, biocompatibility, and similarity to dendrimers. There are many papers …
biodegradability, biocompatibility, and similarity to dendrimers. There are many papers …
Modeling analysis of ionic solvation structure in concentrated poly (ethylene carbonate) electrolytes
Although the performance of all-solid-state batteries has improved greatly in the last few
decades, the lack of understanding of their working mechanism is still a hindrance in many …
decades, the lack of understanding of their working mechanism is still a hindrance in many …
Estimation of the ion conductivity of a PEO-based polyelectrolyte system by molecular modeling
Atomistic molecular modeling has been used to construct amorphous 35.0 wt% water-
containing polymer electrolyte materials consisting of two polymers: poly (ethylene …
containing polymer electrolyte materials consisting of two polymers: poly (ethylene …
[HTML][HTML] Comparison of Structure and Local Dynamics of Two Peptide Dendrimers with the Same Backbone but with Different Side Groups in Their Spacers
In this paper, we perform computer simulation of two lysine-based dendrimers with Lys-2Lys
and Lys-2Gly repeating units. These dendrimers were recently studied experimentally by …
and Lys-2Gly repeating units. These dendrimers were recently studied experimentally by …
A study of influence factors to improve the heat transfer of pure-polydimethylsiloxane (PDMS): A molecular dynamics study
Molecular dynamics simulation were performed to study the influence factors on the heat
transfer of polydimethylsiloxane (PDMS), a kind of thermal interface materials (TIMs). The …
transfer of polydimethylsiloxane (PDMS), a kind of thermal interface materials (TIMs). The …