Search Results - "McCoy, B"

The Role of Electrical Anharmonicity in the Association Band in the Water Spectrum by McCoy, Anne B

“…The origin of the intensity of the feature in the spectrum of liquid water near 2100 cm–1 is investigated through calculations of the spectra of water clusters…”
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Spectroscopic snapshots of the proton-transfer mechanism in water by Wolke, Conrad T., Fournier, Joseph A., Dzugan, Laura C., Fagiani, Matias R., Odbadrakh, Tuguldur T., Knorke, Harald, Jordan, Kenneth D., McCoy, Anne B., Asmis, Knut R., Johnson, Mark A.

“…The Grotthuss mechanism explains the anomalously high proton mobility in water as a sequence of proton transfers along a hydrogen-bonded (H-bonded) network…”
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COVID-19 Severity Is Tripled in the Diabetes Community: A Prospective Analysis of the Pandemic's Impact in Type 1 and Type 2 Diabetes by Gregory, Justin M, Slaughter, James C, Duffus, Sara H, Smith, T Jordan, LeStourgeon, Lauren M, Jaser, Sarah S, McCoy, Allison B, Luther, James M, Giovannetti, Erin R, Boeder, Schafer, Pettus, Jeremy H, Moore, Daniel J

“…To quantify and contextualize the risk for coronavirus disease 2019 (COVID-19)-related hospitalization and illness severity in type 1 diabetes. We conducted a…”
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Towards Equality: An Evolutionary Policy Analysis of Social Security on Gender Inequality by Malyshava, Liudmila, McCoy, B. Oak

“…This inquiry examines the role of federal policy on gender inequality using the principles of institutional adjustment in the context of Veblenian dichotomy of…”
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Exploring the Origins of Spectral Signatures of Strong Hydrogen Bonding in Protonated Water Clusters by Huchmala, Rachel M, McCoy, Anne B

“…The effects of anharmonicity on the spectral features of strong ionic hydrogen bonds are explored through reduced dimensional studies of the couplings between…”
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Infrared-driven unimolecular reaction of CH₃CHOO Criegee intermediates to OH radical products by Liu, Fang, Beames, Joseph M., Petit, Andrew S., McCoy, Anne B., Lester, Marsha I.

“…Ozonolysis of alkenes, an important nonphotolytic source of hydroxyl (OH) radicals in the troposphere, proceeds through energized Criegee intermediates that…”
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Robust Computation of Linear Models by Convex Relaxation by Lerman, Gilad, McCoy, Michael B., Tropp, Joel A., Zhang, Teng

“…Consider a data set of vector-valued observations that consists of noisy inliers, which are explained well by a low-dimensional subspace, along with some…”
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The use of sequential pattern mining to predict next prescribed medications by Wright, Aileen P., Wright, Adam T., McCoy, Allison B., Sittig, Dean F.

“…[Display omitted] •We use sequential pattern mining to identify temporal relationships between drugs.•Mined stepwise patterns of pharmacologic therapy are…”
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An Introduction to the E3SM Special Collection: Goals, Science Drivers, Development, and Analysis by Leung, L. Ruby, Bader, David C., Taylor, Mark A., McCoy, Renata B.

“…Supported by the U.S. Department of Energy (DOE), the Energy Exascale Earth System Model (E3SM) project aims to optimize the use of DOE resources to address…”
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Beyond Badger’s Rule: The Origins and Generality of the Structure–Spectra Relationship of Aqueous Hydrogen Bonds by Boyer, Mark A, Marsalek, Ondrej, Heindel, Joseph P, Markland, Thomas E, McCoy, Anne B, Xantheas, Sotiris S

“…The structure of hydrogen bonded networks is intimately intertwined with their dynamics. Despite the incredibly wide range of hydrogen bond strengths…”
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Development and Validation of a Machine Learning Algorithm Using Clinical Pages to Predict Imminent Clinical Deterioration by Steitz, Bryan D., McCoy, Allison B., Reese, Thomas J., Liu, Siru, Weavind, Liza, Shipley, Kipp, Russo, Elise, Wright, Adam

“…Background Early detection of clinical deterioration among hospitalized patients is a clinical priority for patient safety and quality of care. Current…”
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New onset delirium prediction using machine learning and long short-term memory (LSTM) in electronic health record by Liu, Siru, Schlesinger, Joseph J, McCoy, Allison B, Reese, Thomas J, Steitz, Bryan, Russo, Elise, Koh, Brian, Wright, Adam

“…To develop and test an accurate deep learning model for predicting new onset delirium in hospitalized adult patients. Using electronic health record (EHR) data…”
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Near-Infrared Spectroscopy and Anharmonic Theory of Protonated Water Clusters: Higher Elevations in the Hydrogen Bonding Landscape by McDonald, D. C, Wagner, J. P, McCoy, A. B, Duncan, M. A

“…Near-infrared spectroscopy measurements are presented for protonated water clusters, H+(H2O) n , in the size range of n = 1–8. Clusters are produced in a…”
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Hidden role of intermolecular proton transfer in the anomalously diffuse vibrational spectrum of a trapped hydronium ion by Craig, Stephanie M., Menges, Fabian S., Duong, Chinh H., Denton, Joanna K., Madison, Lindsey R., McCoy, Anne B., Johnson, Mark A.

“…We report the vibrational spectra of the hydronium and methylammonium ions captured in the C3v binding pocket of the 18-crown-6 ether ionophore. Although the…”
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A framework for evaluating the appropriateness of clinical decision support alerts and responses by McCoy, Allison B, Waitman, Lemuel R, Lewis, Julia B, Wright, Julie A, Choma, David P, Miller, Randolph A, Peterson, Josh F

“…Alerting systems, a type of clinical decision support, are increasingly prevalent in healthcare, yet few studies have concurrently measured the appropriateness…”
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Determination of Noncovalent Docking by Infrared Spectroscopy of Cold Gas-Phase Complexes by Garand, Etienne, Kamrath, Michael Z., Jordan, Peter A., Wolk, Arron B., Leavitt, Christopher M., McCoy, Anne B., Miller, Scott J., Johnson, Mark A.

“…Multidentate, noncovalent interactions between small molecules and biopolymer fragments are central to processes ranging from drug action to selective…”
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Isotope Effects in the Zundel–Eigen Isomerization of H+(H2O)6 by Finney, Jacob M., Choi, Tae Hoon, Huchmala, Rachel M., Heindel, Joseph P., Xantheas, Sotiris S., Jordan, Kenneth D., McCoy, Anne B.

“…The isomerization pathway between the energetically low-lying Zundel and Eigen isomers of the protonated water hexamer was investigated using high-level ab…”
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Microhydration of Contact Ion Pairs in M2+OH–(H2O) n=1–5 (M = Mg, Ca) Clusters: Spectral Manifestations of a Mobile Proton Defect in the First Hydration Shell by Johnson, Christopher J, Dzugan, Laura C, Wolk, Arron B, Leavitt, Christopher M, Fournier, Joseph A, McCoy, Anne B, Johnson, Mark A

“…Vibrational predissociation spectra of D2-“tagged” Mg2+OH–(H2O) n=1–6 and Ca2+OH–(H2O) n=1–5 clusters are reported to explore how the M2+OH– contact ion pairs…”
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Identifying antinuclear antibody positive individuals at risk for developing systemic autoimmune disease: development and validation of a real-time risk model by Barnado, April, Moore, Ryan P, Domenico, Henry J, Green, Sarah, Camai, Alex, Suh, Ashley, Han, Bryan, Walker, Katherine, Anderson, Audrey, Caruth, Lannawill, Katta, Anish, McCoy, Allison B, Byrne, Daniel W

“…Positive antinuclear antibodies (ANAs) cause diagnostic dilemmas for clinicians. Currently, no tools exist to help clinicians interpret the significance of a…”
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Efficacy, safety, tolerability and pharmacokinetics of a novel human immune globulin subcutaneous, 20%: a Phase 2/3 study in Europe in patients with primary immunodeficiencies by Borte, M., Kriván, G., Derfalvi, B., Maródi, L., Harrer, T., Jolles, S., Bourgeois, C., Engl, W., Leibl, H., McCoy, B., Gelmont, D., Yel, L.

“…Summary A highly concentrated (20%) immunoglobulin (Ig)G preparation for subcutaneous administration (IGSC 20%), would offer a new option for antibody…”
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