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Ab initio transport properties of nanostructures from maximally localized Wannier functions
Article on ab initio transport properties of nanostructures from maximally localized Wannier functions.
Date:
January 22, 2004
Creator:
Calzolari, Arrigo; Marzari, Nicola; Souza, Ivo & Buongiorno Nardelli, Marco
Object Type:
Article
System:
The UNT Digital Library
ABA Is Required for Plant Acclimation to a Combination of Salt and Heat Stress
This article highlights the important role abscisic acid plays in the acclimation of plants to a combination of two different abiotic stresses.
Date:
January 29, 2016
Creator:
Suzuki, Nobuhiro; Bassil, Elias; Hamilton, Jason S.; Inupakutika, Madhuri A.; Zandalinas, Sara I.; Tripathy, Deesha et al.
Object Type:
Article
System:
The UNT Digital Library
Accurate quantum chemical energies for tetrapeptide conformations: why MP2 data with an insufficient basis set should be handled with caution
This article discusses potential problems if the widely-applied MP2 approach is used in such situations with basis sets of insufficient size.
Date:
January 29, 2013
Creator:
Goerigk, Lars; Karton, Amir; Martin, Jan M. L. & Radom, Leo
Object Type:
Article
System:
The UNT Digital Library
Application of the Correlation Consistent Composite Approach (ccCA) to Third-Row (Ga-Kr) Molecules
Article on the application of the correlation consistent composite approach (ccCA) to third-row (Ga-Kr) molecules.
Date:
January 19, 2008
Creator:
DeYonker, Nathan J.; Mintz, Benjamin; Cundari, Thomas R., 1964- & Wilson, Angela K.
Object Type:
Article
System:
The UNT Digital Library
Are Smoking Cessation Treatments Associated with Suicidality Risk? An Overview
This article explores the relationship between smoking cessation interventions and suicidality and explore common treatments, their associated risks, and effectiveness in promoting smoking reduction and abstinence.
Date:
January 27, 2016
Creator:
Penberthy, J. Kim; Penberthy, J. Morgan; Harris, Marcus R.; Nanda, Sonali; Ahn, Jennifer; Martinez, Caridad Ponce et al.
Object Type:
Article
System:
The UNT Digital Library
Arylpalladium Phosphonate Complexes as Reactive Intermediates in Phosphorus-Carbon Bond Forming Reactions
Article discussing research on arylpalladium phosphonate complexes as reactive intermediates in phosphorus-carbon bond forming reactions.
Date:
January 21, 2009
Creator:
Kohler, Mark C.; Grimes, Thomas V.; Wang, Xiaoping; Cundari, Thomas R., 1964- & Stockland, Robert A., Jr.
Object Type:
Article
System:
The UNT Digital Library
Assessing Caregiver for Team Interventions (ACT): A New Paradigm for Comprehensive Hospice Quality Care
Article on a new paradigm for comprehensive hospice quality care and Assessing Caregivers for Team Interventions (ACT).
Date:
January 14, 2009
Creator:
Demiris, George; Oliver, Debra Parker & Wittenberg-Lyles, Elaine
Object Type:
Article
System:
The UNT Digital Library
The Association between Hantavirus Infection and Selenium Deficiency in Mainland China
This article studies the role of selenium concentration in hemorrhagic fever with renal syndrome (HFRS) caused by hantaviruses, using a multidisciplinary approach combining ecological analysis with preliminary experimental data.
Date:
January 20, 2015
Creator:
Fang, Liqun; Goeijenbier, Marco; Zuo, Shu-Qing; Wang, Li-Ping; Liang, Song; Klein, Sabra L. et al.
Object Type:
Article
System:
The UNT Digital Library
Bioinformatics tools for cancer metabolomics
This review focuses on the use of different bioinformatics tools in cancer metabolomics studies.
Date:
January 12, 2011
Creator:
Blekherman, Grigoriy; Laubenbacher, Reinhard; Cortes, Diego F.; Mendes, Pedro; Torti, Frank M.; Akman, Steven et al.
Object Type:
Article
System:
The UNT Digital Library
Body shape differences in a pair of closely related Malawi cichlids and their hybrids: Effects of genetic variation, phenotypic plasticity, and transgressive segregation
This article investigates the contributions of genetic and plastic components for differences in body shape in two species of Lake Malawi cichlids using wild-caught specimens and a common garden experiment.
Date:
January 28, 2017
Creator:
Husemann, Martin; Tobler, Michael; McCauley, Cagney; Ding, Baoqing & Danley, Patrick D.
Object Type:
Article
System:
The UNT Digital Library
The Butterfly Dimer [(tBu3SiO)Cr]2 (μ-OSitBu3)2 and Its Oxidative Cleavage to (tBu3SiO)2 Cr(=N-N=CPh2)2 and (tBu3SiO)2 Cr=N(2,6-Ph2-C6H3)
Article discussing research on the butterfly dimer [(ᵗBu₃SiO)Cr]₂(μ-OSiᵗBu₃)₂ and its oxidative cleavage to (ᵗBu₃SiO)₂Cr(=N-N=CPh₂)₂ and (ᵗBu₃SiO)₂Cr=N(2,6-Ph₂-C₆H₃).
Date:
January 12, 2006
Creator:
Sydora, Orson L.; Kuiper, David S.; Wolczanski, Peter T.; Lobkovsky, Emil B.; Dinescu, Adriana & Cundari, Thomas R., 1964-
Object Type:
Article
System:
The UNT Digital Library
Calculation of a Methane C-H Oxidative Addition Trajectory: Comparison to Experiment and Methane Activation by High-Valent Complexes
Article discussing research on the calculation of methane C-H oxidative addition trajectory and a comparison to experiment and methane activation by high-valent complexes.
Date:
January 1994
Creator:
Cundari, Thomas R., 1964-
Object Type:
Article
System:
The UNT Digital Library
Carbon-Hydrogen Bond Activation by Titanium Imido Complexes. Computational Evidence for the Role of Alkane Adducts in Selective C-H Activation
This article reports calculations that probe the role of R (hydrocarbon) and R' (ligand substituent) effects on the reaction coordinate for C-H activation.
Date:
January 19, 2002
Creator:
Cundari, Thomas R., 1964-; Klinckman, Thomas R. & Wolczanski, Peter T.
Object Type:
Article
System:
The UNT Digital Library
Catalytic Synthesis of Arylisocyanates from Nitroaromatics. A Computational Study
Article discussing a computational study on the catalytic synthesis of arylisocyanates from nitroaromatics.
Date:
January 10, 2007
Creator:
Kazi, Abul B.; Cundari, Thomas R., 1964-; Baba, Eduard; DeYonker, Nathan J.; Dinescu, Adriana & Spaine, Lloyd
Object Type:
Article
System:
The UNT Digital Library
A chemical genetic screen uncovers a small molecule enhancer of the N-acylethanolamine degrading enzyme, fatty acid amide hydrolase, in Arabidopsis
This article demonstrates the feasibility of using an unbiased chemical genetic approach to identify new pharmacological tools for manipulating FAAH- and NAE-mediated physiological processes in plants.
Date:
January 23, 2017
Creator:
Khan, Bibi Rafeiza; Faure, Lionel; Chapman, Kent D. & Blancaflor, Elison B.
Object Type:
Article
System:
The UNT Digital Library
Coiled-Coil Nanomechanics and Uncoiling and Unfolding of the Superhelix and α-Helices of Myosin
Article on coiled-coil nanomechanics and uncoiling and unfolding of the superhelix and α-helices of myosin.
Date:
January 6, 2006
Creator:
Root, Douglas D.; Yadavalli, Vamsi K.; Forbes, Jeffrey G. & Wang, Kuan
Object Type:
Article
System:
The UNT Digital Library
Comment on "Structural Determinants of Drug Partitioning in Surrogates of Phosphatidylcholine Bilayer Strata"
This article gives comment to a previous article published in 'Molecular Pharmaceuticals' titled, "Structural Determinants of Drug Partitioning in Surrogates of Phosphatidylcholine Bilayer Strata."
Date:
January 13, 2015
Creator:
Acree, William E. (William Eugene); Brumfield, Michela & Abraham, M. H. (Michael H.)
Object Type:
Article
System:
The UNT Digital Library
Commentary on "Solubility and solution thermodynamics of cetilistat in water and (acetone, isopropyl alcohol, acetonitrile) binary solvent mixtures"
This article reanalyzes experimental solubility data reported in the recent paper "Solubility and solution thermodynamics of cetilistat in water and (acetone, isopropyl alcohol, acetonitrile) binary solvent mixtures" in the Journal of Molecular Liquids.
Date:
January 17, 2017
Creator:
Acree, William E. (William Eugene)
Object Type:
Article
System:
The UNT Digital Library
Comparative Assessment of Peer Review: Project Outcomes Report
This report discusses the Comparative Assessment of Peer Review (CAPR) project outcomes. The authors investigate the review process for agencies that fund scientific research.
Date:
January 2013
Creator:
Frodeman, Robert; Holbrook, J. Britt; Moen, William E.; Burggren, Warren W. & Mitcham, Carl
Object Type:
Report
System:
The UNT Digital Library
Comparison of Analytical Methods: Direct Emission versus First-Derivative Fluorometric Methods for Quinine Determination in Tonic Waters
Article on a comparison of analytical methods and a direct emission versus first-derivative fluorometric methods for quinine determination in tonic waters.
Date:
January 1, 1999
Creator:
Pandey, Siddharth; Borders, Tammie L.; Hernández, Carmen E.; Roy, Lindsay Elizabeth; Reddy, Gaddum D.; Martinez, Geo L. et al.
Object Type:
Article
System:
The UNT Digital Library
Complexity matching in neural networks
This article adopts the complexity matching principle that the maximal efficiency of communication between two complex networks is realized when both of them are at criticality, and uses this principle to establish the value of the neuronal interaction strength at which criticality occurs.
Date:
January 9, 2015
Creator:
Mafahim, Javad Usefie; Lambert, David; Zare, Marzieh & Grigolini, Paolo
Object Type:
Article
System:
The UNT Digital Library
Composition of Epoxy Resin, Aliphatic Amine Curing Agent and Halogenated Amine
Patent relating to the composition of epoxy resin, aliphatic amine curing agent and halogenated amine.
Date:
March 10, 2009
Creator:
Bilyeu, Bryan; Brostow, Witold, 1934- & Menard, Kevin P.
Object Type:
Patent
System:
The UNT Digital Library
A computational study of chlorofluoro-methyl radicals
Article on a computational study of chlorofluoro-methyl radicals.
Date:
January 8, 2003
Creator:
Schwartz, Martin; Peebles, Lynda R.; Berry, Rajiv & Marshall, Paul
Object Type:
Article
System:
The UNT Digital Library
A computational study of the enthalpies of formation of halomethylidynes
Article on a computational study of the enthalpies of formation of halomethylidynes.
Date:
January 22, 1999
Creator:
Marshall, Paul; Misra, Ashutosh & Schwartz, Martin
Object Type:
Article
System:
The UNT Digital Library