Publications by authors named "Kevin B Moore"

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CSMILES: A Compact, Human-Readable SMILES Extension for Conformations.
James W Furness, Kevin B Moore, Art Bochevarov

J Chem Inf Model· October 2025

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Quantum chemical package Jaguar: A survey of recent developments and unique features.
Yixiang Cao, Ty Balduf, Michael D Beachy, M Chandler Bennett, Art D Bochevarov, Kevin B Moore

J Chem Phys· August 2024

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Radical Stereochemistry: Accounting for Diastereomers in Kinetic Mechanism Development.
Andreas V Copan, Kevin B Moore, Sarah N Elliott, Clayton R Mulvihill, Luna Pratali Maffei

J Phys Chem A· May 2024

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Adherence to physical activity recommendations and barriers to physical activity participation among adults with type 1 diabetes.
Mary Finn, Mark Sherlock, Sinead Feehan, Emer M Guinan, Kevin B Moore

Ir J Med Sci· August 2022

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Watching a hydroperoxyalkyl radical (•QOOH) dissociate.
Anne S Hansen, Trisha Bhagde, Kevin B Moore, Daniel R Moberg, Ahren W Jasper

Science· August 2021

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Substitution Reactions in the Pyrolysis of Acetone Revealed through a Modeling, Experiment, Theory Paradigm.
Daniel P Zaleski, Raghu Sivaramakrishnan, Hailey R Weller, Nathan A Seifert, David H Bross, Kevin B Moore

J Am Chem Soc· March 2021

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Assessing the Viability of the Methylsulfinyl Radical-Ozone Reaction.
Marissa L Estep, Kevin B Moore, H F Schaefer

Chemphyschem· June 2020

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Sulfurous and sulfonic acids: Predicting the infrared spectrum and setting the surface straight.
Jonathon P Misiewicz, Kevin B Moore, Peter R Franke, W James Morgan, Justin M Turney

J Chem Phys· January 2020

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Large Intermediates in Hydrazine Decomposition: A Theoretical Study of the NH and NH Potential Energy Surfaces.
Alon Grinberg Dana, Kevin B Moore, Ahren W Jasper, William H Green

J Phys Chem A· June 2019

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tert-Butyl peroxy radical: ground and first excited state energetics and fundamental frequencies.
Peter R Franke, Kevin B Moore, Henry F Schaefer, Gary E Douberly

Phys Chem Chem Phys· May 2019

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Noncovalent Interactions between Molecular Hydrogen and the Alkali Fluorides: H-H···F-M (M = Li, Na, K, Rb, Cs). High Level Theoretical Predictions and SAPT Analysis.
Dan Zhou, Guoliang Li, Kevin B Moore, Yaoming Xie, Kirk A Peterson

J Chem Theory Comput· October 2018

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High-level theoretical characterization of the vinoxy radical (CHCHO) + O reaction.
Jared D Weidman, Ryan T Allen, Kevin B Moore, Henry F Schaefer

J Chem Phys· May 2018

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Alkali-Metal Trihalides: MX Ion Pair or MX-X Complex?
Zhi Sun, Kevin B Moore, J Grant Hill, Kirk A Peterson, Henry F Schaefer

J Phys Chem B· April 2018

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Re-examining ammonia addition to the Criegee intermediate: converging to chemical accuracy.
Jonathon P Misiewicz, Sarah N Elliott, Kevin B Moore, Henry F Schaefer

Phys Chem Chem Phys· March 2018

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C-H···O Hydrogen Bonding. The Prototypical Methane-Formaldehyde System: A Critical Assessment.
Kevin B Moore, Keyarash Sadeghian, C David Sherrill, Christian Ochsenfeld, Henry F Schaefer

J Chem Theory Comput· November 2017

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Communication: The Al + CO → AlO + CO reaction: Experiment vs. theory.
Zhi Sun, Kevin B Moore, Henry F Schaefer

J Chem Phys· November 2017

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The fate of the tert-butyl radical in low-temperature autoignition reactions.
Kevin B Moore, Justin M Turney, Henry F Schaefer

J Chem Phys· May 2017

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Liquid hot NAGMA cooled to 0.4 K: benchmark thermochemistry of a gas-phase peptide.
Christopher M Leavitt, Kevin B Moore, Paul L Raston, Jay Agarwal, Grant H Moody

J Phys Chem A· October 2014

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Atomic force microscopy characterization and lithography of Cu-ligated mercaptoalkanoic acid "molecular ruler" multilayers.
Chad I Drexler, Kevin B Moore, Corey P Causey, Thomas J Mullen

Langmuir· July 2014

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Streptococcal hyaluronate lyase reveals the presence of a structurally significant C-H⋅⋅⋅O hydrogen bond.
Kevin B Moore, Angela N Migues, Henry F Schaefer, Robert A Vergenz

Chemistry· January 2014

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Therapeutic potential of dipeptidyl peptidase-IV inhibitors in patients with diabetes mellitus.
Kevin B Moore, Christopher D Saudek

Am J Ther· November 2008

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Glucose fluctuations and oxidative stress.
Kevin B Moore

JAMA· October 2006

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Small-cell lung cancer presenting as diabetes insipidus and Cushing's syndrome.
Amar Agha, Sinead Brennan, Kevin B Moore, Liam Grogan, Christopher J Thompson

Pituitary· June 2006

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Implantable insulin pump therapy: an unusual presentation of a catheter-related complication.
Kevin B Moore, Christopher D Saudek, Alicia Greene, Alan Dackiw

Diabetes Technol Ther· June 2006

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