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Characterization of Reaction Pathways on the Potential Energy Surfaces for H + SO2 and HS + O2
Article on the characterization of reaction pathways on the potential energy surfaces for H + SO2 and HS + O2.
Date:
December 7, 1999
Creator:
Goumri, Abdellatif; Rocha, John-David Ray; Laakso, Dianna; Smith, C. E. & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Modified transition state theory and negative apparent activation energies of simple metathesis reactions: Application to the reaction CH₃ + HBr + CH₄ + Br
Article on modified transition state theory and negative apparent activation energies of simple metathesis reactions and application to the reaction CH₃ + HBr + CH₄ + Br.
Date:
December 18, 2006
Creator:
Krasnoperov, Lev N.; Peng, Jingping & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Population-based analysis of POT1 variants in a cutaneous melanoma case–control cohort
Article describes how pathogenic germline variants in the protection of telomeres 1 gene (POT1) have been associated with predisposition to a range of tumor types, including melanoma, glioma, leukemia and cardiac angiosarcoma. The authors sequenced all coding exons of the POT1 gene in 2928 European-descent melanoma cases and 3298 controls, identifying 43 protein-changing genetic variants.
Date:
December 20, 2022
Creator:
Simonin-Wilmer, Irving; Ossio, Raul; Leddin, Emmett M.; Harland, Mark; Pooley, Karen A.; Martil de la Garza, Mauricio Gerardo et al.
Object Type:
Article
System:
The UNT Digital Library
Kinetic studies of the reaction of atomic hydrogen with trifluoroiodomethane
This article discusses kinetic studies of the reaction of atomic hydrogen with trifluoroiodomethane.
Date:
December 4, 1998
Creator:
Yuan, Jessie; Wells, Leah & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Excited State Charge Separation in Solution and in Electropolymerized Films of Terthiophene-Fullerene Dyad and Phenothiazine-Terthiophene-Fullerene Triad
This article reports synthesis, X-ray structure and excited state events occurring in a terthiophene-C₆₀ dyad (TT-C₆₀), and a phenothiazine-terthiophene-C₆₀ triad (PTZ-TT-C₆₀).
Date:
December 23, 2016
Creator:
Bodenstedt, Kurt; Lim, G. N.; Vdouychenko, Mark; Estrada, Tania; Subbaiyan, Navaneetha K.; Nesterov, Vladimir N. et al.
Object Type:
Article
System:
The UNT Digital Library
Spatial Engineering Direct Cooperativity between Binding Sites for Uranium Sequestration
This article gives a full account of the conceptual and experimental development from randomly distributed functionalities to a convergent arrangement that facilitates cooperative binding is given, thus conferring exceptional affinity toward the analyte of interest. The concept presented here uncovers a new paradigm in the design of efficient sorbent materials by manipulating the spatial distribution to amplify the cooperation of functions.
Date:
December 4, 2020
Creator:
Sun, Qi; Song, Yanpei; Aguila, Briana; Ivanov, Aleksandr S.; Bryantsev, Vyacheslav S. & Ma, Shengqian
Object Type:
Article
System:
The UNT Digital Library
Toward Greener Carbon Capture Technologies: A Pharmacophore-Based Approach to Predict CO₂ Binding Sites in Proteins
This article describes the extraction of three-dimensional functional group patterns responsible for binding CO₂ from the few protein-CO₂ complexes that have been characterized by X-ray crystallography.
Date:
December 4, 2009
Creator:
Drummond, Michael L.; Wilson, Angela K. & Cundari, Thomas R., 1964-
Object Type:
Article
System:
The UNT Digital Library
Development of Abraham model correlations for solvation characteristics of linear alcohols
This article discusses the development of Abraham model correlations for solvation characteristics of linear alcohols.
Date:
December 15, 2009
Creator:
Sprunger, Laura M.; Achi, Sai S.; Pointer, Racheal; Blake-Taylor, Brooke H.; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Object Type:
Article
System:
The UNT Digital Library
Correlation of solute partitioning into isooctane from water and from the gas phase based on updated Abraham equations
This article discusses the correlation of solute partitioning into isooctane from water and from the gas phase based on updated Abraham equations.
Date:
December 1, 2011
Creator:
Stephens, Timothy W.; Wilson, Anastasia; Dabadge, Nishu; Tian, Amy; Zimmerman, Malcolm; Hensley, Hali J. et al.
Object Type:
Article
System:
The UNT Digital Library
Enthalpies of solution and enthalpies of solvation of organic solutes in ethylene glycol at 298.15 K: prediction and analysis of intermolecular interaction contributions
This article studies thermochemistry of solvation of inert gases and organic solutes in ethylene glycol was thoroughly studied using solution calorimetry technique.
Date:
December 24, 2016
Creator:
Stolov, Mikhail; Zaitseva, Ksenia V.; Varfolomeev, Mikhail A. & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
Bulky Lesion Bypass Requires Dpo4 Binding in Distinct Conformations
Article describes study where researchers used single-molecule florescence resonance energy transfer (smFRET) experiments, classical molecular dynamics simulations, and nucleotide incorporation assays to investigate the mechanism by which the model Y-family polymerase, Dpo4, bypasses a (+)-cis-Benzo[a]pyrene (B[a]P)-N 2-dG adduct in DNA.
Date:
December 12, 2017
Creator:
Liyanage, Pramodha S.; Walker, Alice R.; Brenlla, Alfonso; Cisneros, Gerardo Andrés; Romano, Louis J. & Rueda, David S.
Object Type:
Article
System:
The UNT Digital Library
Semi-Covalent Imprinting for Selective Protein Sensing at a Femtomolar Concentration Level
This abstract introduces the development of an inventive new technique for protein imprinting.
Date:
December 4, 2017
Creator:
Dabrowski, Marcin; Cieplak, Maciej; Sharma, Piyush S.; Borowicz, Pawel; Noworyta, K.; Kuhn, Alexander et al.
Object Type:
Article
System:
The UNT Digital Library
Graphene/(Multilayer) Boron Nitride Heteroepitaxy for Electronic Device Applications
Patent relating to graphene/(multilayer) boron nitride heteroepitaxy for electronic device applications.
Date:
September 23, 2011
Creator:
Kelber, Jeffry A.
Object Type:
Patent
System:
The UNT Digital Library
The chemical coupling between moist CO oxidation and gas-phase potassium sulfation
Article discusses how the chemical coupling between moist CO oxidation and transformation of gaseous potassium salts (KCl or KOH) in the presence and absence of SO2 was investigated experimentally and through chemical kinetic modeling. Analysis of the calculations indicates that sulfation pathways in the model involving KOSO3 contribute to the overprediction, but both the thermodynamic properties and rate constants in the model involve significant uncertainties and more work is required to resolve the discrepancy.
Date:
December 15, 2022
Creator:
Chanpirak, Arphaphon; Hashemi, Hamid; Frandsen, Flemming; Wu, Hao; Glarborg, Peter & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Lignocellulosic-Based Activated Carbon-Loaded Silver Nanoparticles and Chitosan for Efficient Removal of Cadmium and Optimization Using Response Surface Methodology
Article expresses how the cadmium-contaminated water body is a worldwide concern for the environment and toxic to human beings and the removal of cadmium ions from drinking and groundwater sustainably and cost-effectively is important. The results showed that synthesized CS-KAC-Ag was a biocompatible and versatile porous filtering material for the decontamination of different toxic metal ions.
Date:
December 13, 2022
Creator:
Mandal, Sujata; Marpu, Sreekar; Omary, Mohammad A.; Dinulescu, Catalin C.; Prybutok, Victor R. & Shi, Sheldon
Object Type:
Article
System:
The UNT Digital Library
Silver and Silver Nanoparticle Maldi Matrix Utilizing Online Soft Landing Ion Mobility
Patent relating to silver and silver nanoparticle maldi matrix utilizing online soft landing ion mobility.
Date:
November 2, 2011
Creator:
Verbeck, Guido F. & Davila, Stephen
Object Type:
Patent
System:
The UNT Digital Library
Descriptors for the Prediction of Partition Coefficients and Solubilities of Organophosphorus Compounds
This article discusses the determination of Abraham descriptors for several series of organophosphorus compounds.
Date:
December 19, 2011
Creator:
Abraham, M. H. (Michael H.) & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
A Europium-Based Optical Sensor for the Detection of Carbon Dioxide and Its Application for a Fermentation Reaction
Article discusses a new europium-based complex, K[Eu(hfa)4] with hfa = hexafluoroacetylacetonate is synthesized and its structure confirmed via X-ray crystallography. Based on the data collected, a highly stable, brightly red-emissive Eu(III) complex with the ability to differentiate concentrations of CO2 in solution is hereby developed and characterized with benefits for various CO2 sensing applications.
Date:
December 21, 2022
Creator:
Benton, Erin N.; Rajitha Perera, Nawagamu A. K.; Nesterov, Vladimir N.; Perera, Wijayantha; Omary, Mohammad A. & Marpu, Sreekar
Object Type:
Article
System:
The UNT Digital Library
Mathematical Representation of Solubility of Electrolytes in Binary Solvent Mixtures Using Jouyban-Acree Model
Article discussing the mathematical representation of the solubility of electrolytes in binary solvent mixtures using the Jouyban-Acree model.
Date:
December 1, 2005
Creator:
Khoubnasabjafari, Maryam; Jouyban, Abolghasem & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
On the mechanism for plasma hydrogenation of graphene
This article discusses the mechanism for plasma hydrogenation of graphene.
Date:
December 6, 2010
Creator:
Jones, Jason D.; Hoffmann, William D.; Jesseph, Aaron V.; Morris, Christopher; Verbeck, Guido F. & Pérez, José M.
Object Type:
Article
System:
The UNT Digital Library
Spectroscopic Properties of Polycyclic Aromatic Hydrocarbons: Effect of Solvent Polarity on the Fluorescence Emission Behavior of Select Fluoranthene, Fluorenochrysene, Indenochrysene, and Indenopyrene Derivatives
Article on the spectroscopic properties of polycyclic aromatic hydrocarbons and the effect of solvent polarity on the fluorescence emission behavior of select fluoranthene, fluorenochrysene, indenochrysene, and indenopyrene derivatives.
Date:
December 1, 1991
Creator:
Tucker, Sheryl A. (Sheryl Ann); Acree, William E. (William Eugene); Cho, Bongsup P.; Harvey, Ronald G. & Fetzer, John Charles, 1953-
Object Type:
Article
System:
The UNT Digital Library
Solubility Prediction of Pyrene in Non-Aqueous Solvent Mixtures Using Jouyban-Acree Model
Article on the solubility prediction of pyrene in non-aqueous solvent mixtures using the Jouyban-Acree model.
Date:
December 20, 2006
Creator:
Jouyban, Abolghasem; Khoubnasabjafari, Maryam & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
A Coupled-Cluster Study of the Enthalpy of Formation of Nitrogen Sulfide, NS
Article on a coupled-cluster study of the enthalpy of formation of nitrogen sulfide, NS.
Date:
December 20, 2002
Creator:
Peebles, Lynda R. & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
Models to Predict Solubility in Ternary Solvents Based on Sub-binary Experimental Data
Article on models to predict solubility in ternary solvents based on sub-binary experimental data.
Date:
December 2000
Creator:
Jouyban, Abolghasem; Clark, Brian J. & Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library