We describe herein an adsorption-induced energy transfer between phenanthrene, a major environmental pollutant, and a fluorescently labeled dendrimer acting as a host molecule. We find experimentally that such energy transfer is the most efficient at a solvent pH of 8 and for a phenanthrene ratio dendrimer molar ratio of 1 ratio 2. Using molecular dynamics simulations we show that the strongest binding interactions occur between phenanthrene and the primary amines of the dendrimer. The simulations provide evidence that at low pH, phenanthrene-phenanthrene interactions are favorable and compete with phenanthrene-dendrimer binding. This study offers a new scheme for detecting dendrimer molecular assembly and a physical basis for exploiting de...
The dynamics of electronic energy transfer (EET) for a series of spherical porphyrin arrays based on...
Dendrimeric nanoparticles are potential drug delivery devices which can enhance the solubility of hy...
Despite their lack of conjugation, polyamidoamine (PAMAM) dendrimers are intrinsically fluorescent, ...
Abstract: We report our single-molecule fluorescence microscopy and molecular dynamics simulation st...
A water soluble third generation poly(alkyl aryl ether) dendrimer was examined for its ability to so...
ABSTRACT: PAMAM (polyamidoamine) dendrimers have been recently exploited as efficient and biocompati...
We present results from experiments and atomistic molecular dynamics simulations on the remediation ...
In this project, we use molecular dynamics simulations to study the behavior of dendrimers, a class ...
Solutions to many future challenges - including water purification, drug delivery, and energy storag...
Dendrimers are branched macromolecules that can be functionalized with a large variety of chemical m...
<div><p>This manuscript reports on the binding of fluorescent polyanionic probes to various generati...
A multi-leveled theoretical investigation combining TD-DFT (B3LYP and CAM-B3LYP) methods and a semi-...
Using several hundred nanoseconds long fully atomistic molecular dynamics simulation we demonstrate ...
We study the complexation of nontoxic, native poly(propyl ether imine) dendrimers with single-walled...
The dynamics of electronic energy transfer (EET) for a series of spherical porphyrin arrays based on...
The dynamics of electronic energy transfer (EET) for a series of spherical porphyrin arrays based on...
Dendrimeric nanoparticles are potential drug delivery devices which can enhance the solubility of hy...
Despite their lack of conjugation, polyamidoamine (PAMAM) dendrimers are intrinsically fluorescent, ...
Abstract: We report our single-molecule fluorescence microscopy and molecular dynamics simulation st...
A water soluble third generation poly(alkyl aryl ether) dendrimer was examined for its ability to so...
ABSTRACT: PAMAM (polyamidoamine) dendrimers have been recently exploited as efficient and biocompati...
We present results from experiments and atomistic molecular dynamics simulations on the remediation ...
In this project, we use molecular dynamics simulations to study the behavior of dendrimers, a class ...
Solutions to many future challenges - including water purification, drug delivery, and energy storag...
Dendrimers are branched macromolecules that can be functionalized with a large variety of chemical m...
<div><p>This manuscript reports on the binding of fluorescent polyanionic probes to various generati...
A multi-leveled theoretical investigation combining TD-DFT (B3LYP and CAM-B3LYP) methods and a semi-...
Using several hundred nanoseconds long fully atomistic molecular dynamics simulation we demonstrate ...
We study the complexation of nontoxic, native poly(propyl ether imine) dendrimers with single-walled...
The dynamics of electronic energy transfer (EET) for a series of spherical porphyrin arrays based on...
The dynamics of electronic energy transfer (EET) for a series of spherical porphyrin arrays based on...
Dendrimeric nanoparticles are potential drug delivery devices which can enhance the solubility of hy...
Despite their lack of conjugation, polyamidoamine (PAMAM) dendrimers are intrinsically fluorescent, ...