56Fe, 16O, 1H Elastic and capture cross sections analysis in PCA-REPLICA benchmark
Sign Up to like & getrecommendations! Published in 2021 at "Progress in Nuclear Energy"
DOI: 10.1016/j.pnucene.2021.103996
Abstract: Abstract The uncertainties in nuclear data give inaccurate values of reaction rates in shielding benchmarks. Consequently, the inclusion of the shielding benchmarks in the validation of the nuclear data would contribute to the production of… read more here.
Keywords: elastic capture; reaction rates; cross; nuclear data ... See more keywords
Accelerating Reaction Rates of Biomolecules by Using Shear Stress in Artificial Capillary Systems
Sign Up to like & getrecommendations! Published in 2021 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.1c03681
Abstract: Biomimetics is a design principle within chemistry, biology, and engineering, but chemistry biomimetic approaches have been generally limited to emulating nature’s chemical toolkit while emulation of nature’s physical toolkit has remained largely unexplored. To begin… read more here.
Keywords: accelerating reaction; rates biomolecules; reaction rates; chemistry ... See more keywords
Electrophilic Aromatic Substitution Reactions: Mechanistic Landscape, Electrostatic and Electric-Field Control of Reaction Rates, and Mechanistic Crossovers.
Sign Up to like & getrecommendations! Published in 2019 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.9b04982
Abstract: This study investigates the rich mechanistic landscape of the iconic electrophilic aromatic substitution (EAS) reaction class, in the gas phase, in solvents, and under stimulation by oriented external electric fields. The study uses DFT calculations,… read more here.
Keywords: reaction rates; control reaction; aromatic substitution; mechanistic landscape ... See more keywords
Fast predictions of liquid-phase acid-catalyzed reaction rates using molecular dynamics simulations and convolutional neural networks†
Sign Up to like & getrecommendations! Published in 2020 at "Chemical Science"
DOI: 10.1039/d0sc03261a
Abstract: The rates of liquid-phase, acid-catalyzed reactions relevant to the upgrading of biomass into high-value chemicals are highly sensitive to solvent composition and identifying suitable solvent mixtures is theoretically and experimentally challenging. We show that the… read more here.
Keywords: molecular dynamics; reaction rates; convolutional neural; acid catalyzed ... See more keywords
Shellac: A Tertiary Care Center Experience.
Sign Up to like & getrecommendations! Published in 2018 at "Dermatitis"
DOI: 10.1097/der.0000000000000394
Abstract: To the Editor: Li students tested with European cosmetic series Warshaw et al 2011–2012 4231 66 (1.6) All patch-tested patients tested with standard series Warshaw et al 2009–2010 4301 74 (1.7) All patch-tested patients tested… read more here.
Keywords: shellac tertiary; reaction rates; series; reaction ... See more keywords
Comparing Measured and Simulated Reaction Rates in Uranium and Nickel Detectors of the BARS-5M–RUN-2 Reactor Complex
Sign Up to like & getrecommendations! Published in 2020 at "Physics of Atomic Nuclei"
DOI: 10.1134/s1063778820080104
Abstract: Nuclear reaction rates in the nickel and uranium detectors placed at different positions within the reactor cores of the TIRAN nuclear reactor complex are measured. The measured reaction rates are found to be consistent with… read more here.
Keywords: reaction rates; comparing measured; reaction; reactor complex ... See more keywords
Quantifying biochemical reaction rates from static population variability within incompletely observed complex networks
Sign Up to like & getrecommendations! Published in 2022 at "PLoS Computational Biology"
DOI: 10.1371/journal.pcbi.1010183
Abstract: Quantifying biochemical reaction rates within complex cellular processes remains a key challenge of systems biology even as high-throughput single-cell data have become available to characterize snapshots of population variability. That is because complex systems with… read more here.
Keywords: reaction rates; reaction; population variability; quantifying biochemical ... See more keywords
Prevalence of allergen sensitization detected by patch tests.
Sign Up to like & getrecommendations! Published in 2018 at "Allergy and asthma proceedings"
DOI: 10.2500/aap.2018.39.4119
Abstract: BACKGROUND Existing literature on the prevalence of positive reactions to allergens is largely derived from dermatologists who practice at large academic centers. Data from other providers, including allergists who practice in various other settings, is… read more here.
Keywords: patch test; patch; reaction rates; prevalence ... See more keywords
Plasticity of Performance Curves Can Buffer Reaction Rates from Body Temperature Variation in Active Endotherms
Sign Up to like & getrecommendations! Published in 2017 at "Frontiers in Physiology"
DOI: 10.3389/fphys.2017.00575
Abstract: Endotherms regulate their core body temperature by adjusting metabolic heat production and insulation. Endothermic body temperatures are therefore relatively stable compared to external temperatures. The thermal sensitivity of biochemical reaction rates is thought to have… read more here.
Keywords: reaction rates; performance; plasticity; body ... See more keywords
Catalytic Oxidation of Benzoins by Hydrogen Peroxide on Nanosized HKUST-1: Influence of Substituents on the Reaction Rates and DFT Modeling of the Reaction Path
Sign Up to like & getrecommendations! Published in 2023 at "Molecules"
DOI: 10.3390/molecules28020747
Abstract: In this research, the oxidation of a series of benzoins, R-C(=O)-CH(OH)-R, where R = phenyl, 4-methoxyphenyl, 4-bromophenyl, and 2-naphthyl, by hydrogen peroxide in the presence of nanostructured HKUST-1 (suspension in acetonitrile/water mixture) was studied. The… read more here.
Keywords: hydrogen peroxide; modeling reaction; oxidation; reaction rates ... See more keywords