Výsledky vyhľadávania - "computational methodologies"

Numerical and Computational Methods in Structural Engineering and Mechanics

“… in computational methodologies. The present reprint contains all the articles accepted and published in the Special Issue…”
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Computational methodology for drug delivery to the inner ear using magnetic nanoparticle aggregates Autor Talaśka, Krzysztof, Wojtkowiak, Dominik, Wilczyński, Dominik, Ferreira, Antoine

“…•A computational methodology using Finite Element Modeling is proposed.•Evaluation of the magnetic forces needed to move magnetic particles are computed and compared to experiments…”
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Developing a ‘personalome’ for precision medicine: emerging methods that compute interpretable effect sizes from single-subject transcriptomes Autor Vitali, Francesca, Li, Qike, Schissler, A Grant, Berghout, Joanne, Kenost, Colleen, Lussier, Yves A

“… from single-subject -omics remain underdeveloped, particularly for quantitative non-sequence measurements, including complete transcriptome…”
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A Computational Methodology for Estimating the Detected Energy Spectra of the Gamma-Ray Flux From Irradiated Nuclear Fuel Autor Senis, L., Elter, Z., Rathore, V., Sunden, E. Andersson, Jansson, P., Holcombe, S., Lindell, M. Aberg, Hakansson, A., Andersson, P.

“… However, the feasibility of examining a particular nuclide of interest is subject to constraints…”
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On topological characterizations and computational analysis of benzenoid networks for drug discovery and development Autor A, Pradeepa, P, Arathi

“… This paper applies established computational methodologies for analyzing benzenoid networks and their application to polycyclic aromatic hydrocarbons (PAHs…”
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The transition between active and inactive conformations of Abl kinase studied by rock climbing and Milestoning Autor Narayan, Brajesh, Fathizadeh, Arman, Templeton, Clark, He, Peng, Arasteh, Shima, Elber, Ron, Buchete, Nicolae-Viorel, Levy, Ron M.

“…Kinases are a family of enzymes that catalyze the transfer of the ɤ-phosphate group from ATP to a protein's residue. Malfunctioning kinases are involved in…”
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The catalytic activity of Abl1 single and compound mutations: Implications for the mechanism of drug resistance mutations in chronic myeloid leukaemia Autor Georgoulia, Panagiota S., Todde, Guido, Bjelic, Sinisa, Friedman, Ran

“…Abl1 is a protein tyrosine kinase whose aberrant activation due to mutations is the culprit of several cancers, most notably chronic myeloid leukaemia. Several…”
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Molecular Paradigms for Biological Mechanosensing Autor Gomez, David, Peña Ccoa, Willmor J, Singh, Yuvraj, Rojas, Enrique, Hocky, Glen M

“…Many proteins in living cells are subject to mechanical forces, which can be generated internally by molecular machines, or externally, e.g…”
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Covalent inhibition of histone deacetylase 8 by 3,4-dihydro-2H-pyrimido[1,2-c][1,3]benzothiazin-6-imine Autor Muth, Marius, Jänsch, Niklas, Kopranovic, Aleksandra, Krämer, Andreas, Wössner, Nathalie, Jung, Manfred, Kirschhöfer, Frank, Brenner-Weiß, Gerald, Meyer-Almes, Franz-Josef

“…HDAC8 is an established target for T-cell lymphoma and childhood neuroblastoma. Benzothiazine-imines are promising HDAC8 inhibitors with unknown binding…”
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Alzheimer's detection using various feature extraction approaches using a multimodal multi‐class deep learning model Autor Goenka, Nitika, Tiwari, Shamik

“… We used three distinct neuroanatomical computational methodologies namely 3D‐Subject, 3D‐Patches, and 3D‐Slices to construct a multimodal multi…”
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Conformational ensemble of an intrinsically flexible loop in mitochondrial import protein Tim21 studied by modeling and molecular dynamics simulations Autor Srivastava, Arpita, Bala, Siqin, Motomura, Hajime, Kohda, Daisuke, Tama, Florence, Miyashita, Osamu

“…Tim21, a subunit of a highly dynamic translocase of the inner mitochondrial membrane (TIM23) complex, translocates proteins by interacting with subunits in the…”
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Connecting the dots: approaching a standardized nomenclature for molecular connectivity in positron emission tomography Autor Reed, Murray B., Cocchi, Luca, Sander, Christin Y., Chen, Jingyuan, Matheson, Granville J., Fisher, Patrick, Volpi, Tommaso, Khattar, Nikkita, DeLorenzo, Christine, Gryglewski, Gregor, Silberbauer, Leo R., Murgaš, Matej, Godbersen, Godber M., Nics, Lukas, Walter, Martin, Hacker, Marcus, Bertoldo, Alessandra, Lubberink, Mark, Silfstein, Mark, Ogden, R. Todd, Mann, J. John, Suhara, Tetsuya, Varrone, Andrea, Boellaard, Ronald, Gunn, Roger N., Hammers, Alexander, Biswal, Bharat, Rosen, Bruce, Knudsen, Gitte M., Carson, Richard, Price, Julie, Lanzenberger, Rupert, Hahn, Andreas

“…Positron emission tomography (PET)-based connectivity analysis provides a molecular perspective that complements fMRI-derived functional connectivity. However,…”
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Exploiting the interplay between cross-sectional and longitudinal data in Class III malocclusion patients Autor Barelli, Enrico, Ottaviani, Ennio, Auconi, Pietro, Caldarelli, Guido, Giuntini, Veronica, McNamara, James A., Franchi, Lorenzo

“… To this purpose we used computational methodologies such as Transductive Learning (TL), Boosting (B), and Feature Engineering…”
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Improving the Catalytic Power of the DszD Enzyme for the Biodesulfurization of Crude Oil and Derivatives Autor Ferreira, Pedro, Sousa, Sérgio F., Fernandes, Pedro A., Ramos, Maria João

“…The enhancement of the catalytic power of enzymes is a subject of enormous interest both for science and for industry…”
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Hydrogen-activation mechanism of [Fe] hydrogenase revealed by multi-scale modelingElectronic supplementary information (ESI) available: Computational methodology, additional data. See DOI: 10.1039/c4sc01605j Autor Finkelmann, Arndt Robert, Senn, Hans Martin, Reiher, Markus

“…When investigating the mode of hydrogen activation by [Fe] hydrogenases, not only is the chemical reactivity at the active site of importance but also the…”
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Novel half Salphen cobalt(III) complexes: synthesis, DNA binding and anticancer studies Autor Bonsignore, Riccardo, Trippodo, Elisa, Di Gesù, Roberto, Carreca, Anna Paola, Rubino, Simona, Spinello, Angelo, Terenzi, Alessio, Barone, Giampaolo

“…) has emerged as a subject of considerable interest due to its ubiquitous role in human physiology…”
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Scientometric evaluation of 100-year history of Poultry Science (1921–2020) Autor Vaziri, Esmaeil, Maghsoudi, Ali, Feizabadi, Mansoureh, Faraji-Arough, Hadi, Rokouei, Mohammad

“…To have a better contribution to the poultry production community, the Poultry Science Association founded journals including Poultry Science (PS) at 1921…”
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General mathematical formulation of scattering processes in atom-diatomic collisions in the RmatReact methodology Autor McKemmish, Laura K, Tennyson, Jonathan

“…], requires the development of new theoretical and computational methodologies. One potentially useful framework is the R-matrix method adopted widely for electron…”
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DiGAS: Differential gene allele spectrum as a descriptor in genetic studies Autor Aparo, Antonino, Bonnici, Vincenzo, Avesani, Simone, Cascione, Luciano, Giugno, Rosalba

“…Diagnosing individuals with complex genetic diseases is a challenging task. Computational methodologies exploit information at the genotype level by taking into account single nucleotide polymorphisms (SNPs…”
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Results and lessons learned from the sbv IMPROVER metagenomics diagnostics for inflammatory bowel disease challenge Autor Khachatryan, Lusine, Xiang, Yang, Ivanov, Artem, Glaab, Enrico, Graham, Garrett, Granata, Ilaria, Giordano, Maurizio, Maddalena, Lucia, Piccirillo, Marina, Manipur, Ichcha, Baruzzo, Giacomo, Cappellato, Marco, Avot, Batiste, Stan, Adrian, Battey, James, Lo Sasso, Giuseppe, Boue, Stephanie, Ivanov, Nikolai V., Peitsch, Manuel C., Hoeng, Julia, Falquet, Laurent, Di Camillo, Barbara, Guarracino, Mario R., Ulyantsev, Vladimir, Sierro, Nicolas, Poussin, Carine

“… The sbv IMPROVER metagenomics diagnosis for inflammatory bowel disease challenge investigated computational metagenomics methods for discriminating IBD and nonIBD subjects…”
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