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values increased » cases increased (Expand Search), also increased (Expand Search), rate increased (Expand Search)
larger decrease » marked decrease (Expand Search)
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Mechanism of Peroxynitrite Interaction with Ferric <i>M. tuberculosis</i> Nitrobindin: A Computational Study
Published 2024“…In this work, we shed light on the molecular basis of the ONOO<sup>–</sup> and ONOOH reactivity of ferric <i>Mycobacterium tuberculosis</i> Nb (<i>Mt</i>-Nb(III)) by dissecting the ligand migration toward the active site, the water molecule release, and the ligand binding process by computer simulations. …”
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Mechanism of Peroxynitrite Interaction with Ferric <i>M. tuberculosis</i> Nitrobindin: A Computational Study
Published 2024“…In this work, we shed light on the molecular basis of the ONOO<sup>–</sup> and ONOOH reactivity of ferric <i>Mycobacterium tuberculosis</i> Nb (<i>Mt</i>-Nb(III)) by dissecting the ligand migration toward the active site, the water molecule release, and the ligand binding process by computer simulations. …”
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S1 Dataset -
Published 2024“…Deep learning models exhibited improved performance for more extensive datasets and exhibited higher levels of accuracy in concurrence with increasingly large datasets. Availability of appropriate datasets remains a primary challenge, potentially resolvable using data augmentation techniques. …”
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Thermal Conductivity of a Fluid-Filled Nanoporous Material: Underlying Molecular Mechanisms and the <i>Rattle</i> Effect
Published 2024“…With striking phenomena such as the so-called <i>rattle</i> effect, through which fluid/solid collisions decrease the overall thermal conductivity, the solid thermal conductivity and, more generally, heat transfer and dispersion in these complex systems challenge classical approaches (e.g., mixing rules including effective medium approaches fail to capture such effects as shown here). …”
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Host-to-tick transmission of <i>B</i>. <i>burgdorferi</i> from infected male and female C3H/HeJ mice to immature <i>I</i>. <i>scapularis</i> ticks decreased over the course of the...
Published 2023“…<i>burgdorferi</i>. The highly significant 2-way interaction between mouse sex and infestation (p = 0.0002) indicates that the decrease in the HTT over time was larger in the female mice compared to the male mice.…”
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