Showing 1,201 - 1,220 results of 21,428 for search '"computer"', query time: 0.07s Refine Results
  1. 1201

    Understanding Dioxygen Activation in the Fe(III)-Promoted Oxidative Dehydrogenation of Amines: A Computational Study by Ricardo D. Páez-López, Miguel Á. Gómez-Soto, Héctor F. Cortés-Hernández, Alejandro Solano-Peralta, Miguel Castro, Peter M. H. Kroneck, Martha E. Sosa-Torres

    Published 2025-01-01
    “…The DFT calculations show that (i) <sup>3</sup>O<sub>2</sub> abstracts a hydrogen atom from the α-pyridine aliphatic C-H moiety, introducing a double bond regio-selectively at the C<sub>7</sub>N<sub>8</sub> position, via the hydrogen atom transfer (HAT) mechanism, (ii) O<sub>2</sub> does not coordinate to the iron center to generate a high-valent Fe oxo species observed in enzymes and biomimetic complexes, and (iii) the experimental activation parameters (ΔH<sup>≠</sup> = 20.38 kcal mol<sup>−1</sup>, ΔS<sup>≠</sup> = −0.018 kcal mol<sup>−1</sup> K<sup>−1</sup>) fall within in the range of values reported for HAT reactions and align well with the computational results for the activated complex [Fe<sup>II</sup>L<sup>3</sup><sub>N8•</sub>]<sup>2+</sup>···<sup>3</sup>O<sub>2</sub>.…”
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  2. 1202

    How to Use CorelDRAW! / by Craig, Deborah

    Published 1994
    Subjects:
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    Book
  3. 1203

    Layout and composition for animation / by Ghertner, Ed

    Published 2010
    Subjects: “…Computer animation. 4145…”
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    Book
  4. 1204

    Advancements in the Application of Convolutional Neural Networks in Ultrasound Imaging for Breast Cancer Diagnosis and Treatment by An Zichen, Li Fan

    Published 2025-03-01
    Subjects: “…|breast cancer|ultrasonography|computer neural networks…”
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    AIding, Not Replacing, Clinicians by Sean Lal, MD, PhD

    Published 2025-02-01
    Subjects: “…computer modeling…”
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  9. 1209

    Edición especial en Ingeniería Eléctrica, Telecomunicaciones y Ciencias de la Computación by Dora Maria Ballesteros

    Published 2019-06-01
    Subjects: “…Electrical Engineering; Telecommunications Engineering; Computer Science…”
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    Article
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