Articles with "reaction pathways" as a keyword



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Single-Molecule Fluorescence Energy Transfer Assays for the Characterization of Reaction Pathways of miRNA-Argonaute Complex.

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Published in 2017 at "Methods in molecular biology"

DOI: 10.1007/978-1-4939-6563-2_21

Abstract: Argonaute proteins are key components of the microRNA-induced silencing complexes (miRISCs) that mediate the posttranscriptional gene silencing of microRNAs and small interfering RNA (siRNAs). The complex reaction mechanism of miRISC is expected to be characterized… read more here.

Keywords: argonaute; molecule fluorescence; single molecule; reaction pathways ... See more keywords
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Finding Dominant Reaction Pathways via Global Optimization of Action

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Published in 2017 at "Biophysical Journal"

DOI: 10.1016/j.bpj.2016.11.1570

Abstract: We present a new computational approach to sample multiple reaction pathways with fixed initial and final states through global optimization of Onsager-Machlup action using the conformationalspace annealing method. This approach successfully samples not only the… read more here.

Keywords: global optimization; reaction pathways; action; approach ... See more keywords

Exploring Reaction Pathways for Peptidylprolyl-Isomerase

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Published in 2017 at "Biophysical Journal"

DOI: 10.1016/j.bpj.2016.11.2407

Abstract: Pin1 enzyme is one of the peptidyl-prolyl cis/trans isomerases (PPIase), which isomerizes an omega bond of specific phospho-Serine/Threonine-Proline motifs, leading to many biological consequences. However, the isomerization mechanism has not been fully clarified yet though… read more here.

Keywords: chem; reaction pathways; peptidylprolyl isomerase; reaction ... See more keywords
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Correlating furfural reaction pathways with interactions between furfural and monometallic surfaces

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Published in 2020 at "Catalysis Today"

DOI: 10.1016/j.cattod.2018.10.004

Abstract: Abstract Controlling the furfural reaction pathways is an important step toward valorizing this important platform chemical in biomass conversion. In this work, high resolution electron energy loss spectroscopy (HREELS) and temperature programmed desorption (TPD) are… read more here.

Keywords: correlating furfural; reaction pathways; pathways interactions; furfural reaction ... See more keywords
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Modeling the effect of an anion on the free energy surfaces along the reaction pathways of oxygen reduction on Pt(1 1 1)

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Published in 2019 at "Chemical Physics Letters"

DOI: 10.1016/j.cplett.2019.136813

Abstract: Abstract By ab initio molecular dynamics simulations, we examined the variation in the oxygen reduction reaction pathways on Pt(1 1 1) in the presence of H, HBr or HClO4, with dozens of explicit water molecules. The free… read more here.

Keywords: reaction pathways; free energy; effect anion; oxygen reduction ... See more keywords
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Study on the reaction pathways of steam methane reforming for H2 production

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Published in 2020 at "Energy"

DOI: 10.1016/j.energy.2020.118296

Abstract: Abstract Steam methane reforming is a common commercial technology for practical H2 production. The steam methane reforming process is numerically studied in this work. The key elementary reactions and intermediate species are analyzed to reveal… read more here.

Keywords: reaction pathways; methane reforming; steam methane; steam ... See more keywords
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Insights into the reaction pathways and mechanism of NO removal by SDBD plasma via FT-IR measurements

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Published in 2019 at "Fuel Processing Technology"

DOI: 10.1016/j.fuproc.2018.12.022

Abstract: Abstract Reaction pathways and specific mechanism of NO removal by non-thermal plasma (NTP) were for the first time investigated via FT-IR measurements. It was found that NO removal was attributed to a co-effect of N… read more here.

Keywords: via measurements; mechanism removal; reaction; reaction pathways ... See more keywords
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First-principles and experimental study of CF 2 transformation to CF 3 reaction pathways on KF(111) surface

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Published in 2018 at "Molecular Catalysis"

DOI: 10.1016/j.mcat.2017.11.001

Abstract: Abstract The surface chemistry of :CF 2 over the KF(111) surface is systematically investigated using periodic, self-consistent, density functional theory (DFT), based on experimental results and elucidated catalysis reaction pathways as a “fluorine pool” mechanism.… read more here.

Keywords: reaction pathways; surface; study; fluorine pool ... See more keywords
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Reaction Pathways of the Selective Catalytic Reduction of NO with NH3 on the α-Fe2O3(012) Surface: a Combined Experimental and DFT Study.

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Published in 2021 at "Environmental science & technology"

DOI: 10.1021/acs.est.1c01628

Abstract: Fe2O3-based catalysts have promising potential in the selective catalytic reduction (SCR) of NO with NH3 with the advantages of environmental friendliness, excellent medium-high SCR activity, good N2 selectivity, and high SO2 tolerance. However, the NH3-SCR… read more here.

Keywords: catalytic reduction; scr; selective catalytic; reaction pathways ... See more keywords
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Identification of Reaction Pathways and Kinetic Modelingof Olefin Interconversion over an H‑ZSM‑5 Catalyst

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Published in 2020 at "Industrial & Engineering Chemistry Research"

DOI: 10.1021/acs.iecr.0c01747

Abstract: Kinetic investigations with a commercial H-ZSM-5 catalyst were performed to enable the modeling of the interconversion reactions of olefins in a temperature range from 420 to 490 °C. Different olef... read more here.

Keywords: zsm catalyst; reaction pathways; identification reaction; pathways kinetic ... See more keywords
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Bismuth for Controlled Assembly/Disassembly of Transition-Metal Oxo Clusters, Defining Reaction Pathways in Inorganic Synthesis and Nature.

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Published in 2020 at "Inorganic chemistry"

DOI: 10.1021/acs.inorgchem.9b03646

Abstract: Trivalent bismuth is a unique heavy p-block ion. It is highly insoluble in water, due to strong hydrolysis tendencies, and known for low toxicity. Its lone pair is structure-directing, providing framework materials with structural flexibility,… read more here.

Keywords: oxo clusters; reaction pathways; metal; metal oxo ... See more keywords