Josie Hendrix
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View article: Hydrogen ejection from hydrocarbons: Characterization and relevance in soot formation and interstellar chemistry
Hydrogen ejection from hydrocarbons: Characterization and relevance in soot formation and interstellar chemistry Open
Polycyclic aromatic hydrocarbons (PAHs) play a major role in the chemistry of combustion, pyrolysis, and the interstellar medium. Production (or activation) of radical PAHs and propagation of their resulting reactions require efficient deh…
View article: Quantum chemical exploration of the binding motifs and binding energies of neutral molecules, radicals and ions with small water clusters: characterisation and astrochemical implications
Quantum chemical exploration of the binding motifs and binding energies of neutral molecules, radicals and ions with small water clusters: characterisation and astrochemical implications Open
Accurate binding energies of molecules to water clusters are relevant for understanding intermolecular interactions and various chemical applications. They enter models of interstellar chemical processes, as binding to icy grains influence…
View article: Cation, Anion, and Radical Isomers of C<sub>4</sub>H<sub>4</sub>N: Computational Characterization and Implications for Astrophysical and Planetary Environments
Cation, Anion, and Radical Isomers of C<sub>4</sub>H<sub>4</sub>N: Computational Characterization and Implications for Astrophysical and Planetary Environments Open
Nitrogen-containing ions and molecules in the gas phase have been detected in non-Earth environments such as dark molecular clouds and more recently in the atmosphere of Saturn's moon Titan. These molecules may serve as precursors to large…
View article: RNA-dependent structures of the RNA-binding loop in the flavivirus NS3 helicase
RNA-dependent structures of the RNA-binding loop in the flavivirus NS3 helicase Open
The flavivirus NS3 protein is a helicase that has pivotal functions during the viral genome replication process, where it unwinds double-stranded RNA and translocates along the nucleic acid polymer in a nucleoside triphosphate hydrolysis-d…
View article: Probing solvation and reactivity in ionized polycyclic aromatic hydrocarbon–water clusters with photoionization mass spectrometry and electronic structure calculations
Probing solvation and reactivity in ionized polycyclic aromatic hydrocarbon–water clusters with photoionization mass spectrometry and electronic structure calculations Open
Synchrotron based mass spectrometry coupled with theoretical calculations provides insight into polycyclic aromatic hydrocarbon water interactions.
View article: Allostery in the dengue virus NS3 helicase: Insights into the NTPase cycle from molecular simulations
Allostery in the dengue virus NS3 helicase: Insights into the NTPase cycle from molecular simulations Open
The C-terminus domain of non-structural 3 (NS3) protein of the Flaviviridae viruses (e.g. HCV, dengue, West Nile, Zika) is a nucleotide triphosphatase (NTPase) -dependent superfamily 2 (SF2) helicase that unwinds double-stranded RNA while …