Search results for "complex"

showing 10 items of 5889 documents

Simulating multilevel dynamics of antimicrobial resistance in a membrane computing model

2019

Membrane computing is a bio-inspired computing paradigm whose devices are the so-called membrane systems or P systems. The P system designed in this work reproduces complex biological landscapes in the computer world. It uses nested “membrane-surrounded entities” able to divide, propagate, and die; to be transferred into other membranes; to exchange informative material according to flexible rules; and to mutate and be selected by external agents. This allows the exploration of hierarchical interactive dynamics resulting from the probabilistic interaction of genes (phenotypes), clones, species, hosts, environments, and antibiotic challenges. Our model facilitates analysis of several aspects…

antibiotic resistanceComputer scienceAntibiotic resistanceComplex systemComputational biologyEcological and Evolutionary ScienceMicrobiology03 medical and health sciencesAntibiotic resistancePlasmidmultilevelVirologyDrug Resistance BacterialMembrane computingHumansComputer SimulationSelection GeneticMembrane computingcomputer modeling030304 developmental biology0303 health sciencesBacteria030306 microbiologyComputer modelingMultilevel modelProbabilistic logicmathematical modelingMultilevelQR1-502Patient flowAnti-Bacterial Agentsmembrane computingMathematical modelingLENGUAJES Y SISTEMAS INFORMATICOSResearch Article
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Solvent-dependent hypsochromic shift in the imidazole based complex [Cu(µ2-SO4)(Im)4] and ameliorative effects on breast cancer-induced bone metastas…

2023

A sulfate-bridged complex [Cu(µ2-SO4)(Im)4] (1) was prepared and structurally characterized, where Im: imidazole. The X-ray structure analysis reveals that 1 crystallizes in the monoclinic system with space group C2/c. The octahedral coordination around the metal center is made up of four distinct imine nitrogen atoms in the equatorial plane, and two sulfate oxygen atoms occupying the axial sites. The covalent linkage between metals via the sulfate group, forming infinite 1D zigzag chains, ensures the entanglement of the structure. These chains, in turn, are further assembled into a 2D network through N-H...O hydrogen bonding. Thermal analyses underline the high thermal stability of our com…

antioksidantitimidazole-based complexesbreast cancersyöpäsolutantioxidant potentialbone metastasesbioaktiiviset yhdisteetGeneral Chemical Engineeringhypsochromic shiftkupariGeneral Chemistryoxidative damagekompleksiyhdisteet
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Catalysis Concepts in Medicinal Inorganic Chemistry

2018

Catalysis has strongly emerged in the field of medicinal inorganic chemistry as a suitable tool to deliver new drug candidates and to overcome drawbacks associated to metallodrugs. In this Concept article, we discuss representative examples of how catalysis has been applied in combination with metal complexes to deliver new therapy approaches. In particular, we explain key achievements in the design of catalytic metallodrugs that damage biomolecular targets and in the development of metal catalysis schemes for the activation of exogenous organic prodrugs. Moreover, we discuss our recent discoveries on the flavin-mediated bioorthogonal catalytic activation of metal-based prodrugs; a new cata…

antiproliferationChemistry PharmaceuticalInorganic chemistryAntineoplastic Agents010402 general chemistry01 natural sciencesCatalysisCatalysisCatalysibioinorganic chemistryAntineoplastic AgentCoordination ComplexesInorganic ChemicalHumansProdrugsmetallodrugInorganic ChemicalphotochemistryCoordination Complexe010405 organic chemistryChemistryOrganic ChemistryGeneral Chemistry0104 chemical sciencesInorganic ChemicalsSettore CHIM/03 - Chimica Generale E InorganicaBioorthogonal chemistryprodrugHuman
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Dipeptides of S-Substituted Dehydrocysteine as Artzyme Building Blocks: Synthesis, Complexing Abilities and Antiproliferative Properties †

2021

Background: Dehydropeptides are analogs of peptides containing at least one conjugate double bond between α,β-carbon atoms. Its presence provides unique structural properties and reaction centre for chemical modification. In this study, the series of new class of dipeptides containing S-substituted dehydrocysteine with variety of heterocyclic moieties was prepared. The compounds were designed as the building blocks for the construction of artificial metalloenzymes (artzymes). Therefore, the complexing properties of representative compounds were also evaluated. Furthermore, the acknowledged biological activity of natural dehydropeptides was the reason to extend the study for antiproliferativ…

antiproliferative activityBALB 3T3 CellsDouble bondPotentiometric titrationSulforhodamine BTriazoleAntineoplastic Agents010402 general chemistry01 natural sciencesCatalysisArticlelcsh:ChemistryInorganic ChemistryMiceStructure-Activity Relationshipchemistry.chemical_compoundElimination reactionCell Line TumorAnimalsHumansChelationCysteinePhysical and Theoretical Chemistrydehydrocysteinelcsh:QH301-705.5Molecular BiologySpectroscopyCell Proliferationchemistry.chemical_classification010405 organic chemistryOrganic ChemistryChemical modificationDipeptidesGeneral MedicineHydrogen-Ion ConcentrationCombinatorial chemistryEnzymes0104 chemical sciencesComputer Science Applicationsdehydropeptideslcsh:Biology (General)lcsh:QD1-999chemistrycomplexing agentaddition-elimination reactionDrug Screening Assays AntitumorCopperConjugateInternational Journal of Molecular Sciences
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A classification of $\protect \mathbb{R}$-Fuchsian subgroups of Picard modular groups

2018

arithmetic Fuchsian groupsmatematiikkaball quotientartimetiikkaquaternion algebrahyperbolinen geometriageometriahyperspherealgebraPicard modular groupHeisenberg groupFuchsin ryhmätcomplex hyperbolic geometry
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Managing the complexity of green innovation

2022

PurposeGreen innovation can promote both environmental sustainability and economic growth. However, its development and implementation can be complex due to the need to align innovation activities within and across companies. In this study, the authors examined how this complexity can be managed by analyzing how individual companies combine different innovation activities to develop green innovation, and how companies along the value chain align to implement these innovations.Design/methodology/approachThe dataset comprises both interviews and a survey of senior executives from the Swedish wood construction industry. These data were first analyzed by using fuzzy set qualitative comparative …

arvoketjutympäristökestävä kehitysvihreä talousGreen innovationComplexityinnovaatiottalouskasvuValue chainManagement of Technology and InnovationSustainable developmentfsQCAInnovationBusiness AdministrationFöretagsekonomi
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Enseigner/Faire comprendre ce que recouvre la notion de territoire en formation d’ASS

2017

International audience; Cette contribution vise à rendre compte d'une expérience de mise en œuvre d'enseignements relatifs à la complexité des territoires en filière d'Assistant(e)s de Service Social (ASS), à l'IRTS de Franche-Comté. Il a été en effet reconnu que ces enseignements alimentaient fortement les écrits en lien avec les périodes de stage et devaient s'inscrire de manière progressive au sein des trois années deformation. Testés depuis près de trois ans, le positionnement des différentes interventions et leur mis en lien sur la durée de la formation est aujourd'hui validé et entre dans une période d'application qui donne d'ores et déjà d'excellents résultats. Nous souhaitons par ce…

assistant(e) social(e)Développement local[SHS.GEO] Humanities and Social Sciences/GeographyTerritoireTrainingComplexitéFormationLocal development[SHS.GEO]Humanities and Social Sciences/GeographyComplexityTerritory[ SHS.GEO ] Humanities and Social Sciences/Geography
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Theoretical characterization of the photochemical reaction CO2+O(3P)→CO+O2 related to experiments in solid krypton

2020

Formation and decomposition of the complex of carbon dioxide and atomic oxygen are characterized by quantum chemistry methods aiming to rationalize experimental studies in solid krypton. The observed FTIR spectra reflected the temporal evolution of the system after irradiation showing the bands of reactants, intermediates and products. Advanced quantum chemistry calculations show that the T-shape complex CO2…O(3P) can be formed in the matrix. Its excitation by the 193 nm light results in the charge-transfer state CO2+…O-, which evolves to the reaction intermediate CO3. The latter species decomposes to CO + O2 following pathways on the excited state energy surfaces. peerReviewed

atomic oxygenquantum chemistryhiilidioksidiphotochemistryhappikvanttikemiacarbon dioxidematrix isolationmolekyylitintermolecular complexesvalokemiaexcited states
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Théorie de l'auto organisation critique

2008

National audience; La théorie de l'auto-organisation critique est une théorie de la complexité qui permet d'étudier les changements brutaux du comportement d'un système. Cette théorie enseigne que certains systèmes, composés d'un nombre important d'éléments en interaction dynamique, évoluent vers un état critique, sans intervention extérieure et sans paramètre de contrôle. L'amplification d'une petite fluctuation interne peut mener à un état critique et provoquer une réaction en chaîne menant à une catastrophe (au sens de changement de comportement d'un système).

auto organisation[SHS.GEO] Humanities and Social Sciences/Geographysystème complexe[SHS.GEO]Humanities and Social Sciences/Geographycriticalité[ SHS.GEO ] Humanities and Social Sciences/Geographythéorie
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The deubiquitinase USP11 is a versatile and conserved regulator of autophagy

2021

Autophagy is a major cellular quality control system responsible for the degradation of proteins and organelles in response to stress and damage to maintain homeostasis. Ubiquitination of autophagy-related proteins or regulatory components is important for the precise control of autophagy pathways. Here, we show that the deubiquitinase ubiquitin-specific protease 11 (USP11) restricts autophagy and that KO of USP11 in mammalian cells results in elevated autophagic flux. We also demonstrate that depletion of the USP11 homolog H34C03.2 in Caenorhabditis elegans triggers hyperactivation of autophagy and protects the animals against human amyloid-β peptide 42 aggregation-induced paralysis. USP11…

autophagyhAβ42 human amyloid-β protein 1 to 42Lipid kinase activityPI(3)P phosphatidylinositol-3-phosphatemTORC1BiochemistryCell LineGene Knockout Techniqueschemistry.chemical_compoundubiquitinAnimalsHumansULK1 unc-51-like autophagy activating kinase 1WIPI WD-repeat domain phosphoinositide-interacting proteinPI3KC3-C1Caenorhabditis elegansCaenorhabditis elegans ProteinsmTORC1Molecular BiologyMechanistic target of rapamycinUSP11 ubiquitin-specific protease 11proteostasisAmyloid beta-PeptidesS6K S6 kinasebiologyPhosphatidylinositol 3-phosphateAutophagyDUB deubiquitinaseLFQ label-free quantificationIP immunoprecipitationNHT nonhuman targetingPI3KC3-C1 class III phosphatidylinositol 3-kinase complex ICell BiologyACN acetonitrile amyloid-βNRBF2 nuclear receptor-binding factor 2Peptide FragmentsCell biologydeubiquitinase (DUB)ProteostasischemistryProteotoxicitymTORC1 mechanistic target of rapamycin complex 1biology.proteinAutophagy-Related Protein-1 HomologBSA bovine serum albuminThiolester HydrolasesResearch ArticleJournal of Biological Chemistry
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