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Results of simulating the ability of pBO, BO and random search algorithms on identifying the optima in the Hartmann 3-dimensional surface.
Published 2021“…<b>b)</b> Shows the Euclidean distance of the identified optima from the true optima of the Hartmann function (i.e., accuracy of the algorithm). …”
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Algorithm timings on a laptop computer with Intel i9–9900K CPU, 32GB RAM and an NVIDIA RTX2080 GPU.
Published 2021Subjects: -
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Demographic and clinical characteristics of participants included in the BNA neuromarker.
Published 2022Subjects: -
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Correlation between the BNA neuromarker linear scores and the mUPDRS scores.
Published 2022Subjects: -
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The Blood–Brain Barrier (BBB) Score
Published 2019“…An algorithm, designated “BBB Score”, composed of stepwise and polynomial piecewise functions, is herein proposed for predicting BBB penetration based on five physicochemical descriptors: number of aromatic rings, heavy atoms, MWHBN (a descriptor comprising molecular weight, hydrogen bond donor, and hydrogen bond acceptors), topological polar surface area, and pKa. …”
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The Blood–Brain Barrier (BBB) Score
Published 2019“…An algorithm, designated “BBB Score”, composed of stepwise and polynomial piecewise functions, is herein proposed for predicting BBB penetration based on five physicochemical descriptors: number of aromatic rings, heavy atoms, MWHBN (a descriptor comprising molecular weight, hydrogen bond donor, and hydrogen bond acceptors), topological polar surface area, and pKa. …”
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139
The Blood–Brain Barrier (BBB) Score
Published 2019“…An algorithm, designated “BBB Score”, composed of stepwise and polynomial piecewise functions, is herein proposed for predicting BBB penetration based on five physicochemical descriptors: number of aromatic rings, heavy atoms, MWHBN (a descriptor comprising molecular weight, hydrogen bond donor, and hydrogen bond acceptors), topological polar surface area, and pKa. …”
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