Search results for "Computation"

showing 10 items of 7362 documents

Stellar hydrodynamics with glaister's riemann solver: An approach to the stellar collapse

1990

La resolution de Remann approximee de la solution des equations d'Euler de la dynamique des gaz 1 D, developpee par Glaister P. (1988, J. Comput. Phys., 74) est introduite dans un code hydrodynamique lagrangien et appliquee a l'effondrement stellaire a symetrie spherique

Cauchy problemPhysicsNumerical AnalysisPhysics and Astronomy (miscellaneous)Applied MathematicsWhite dwarfGas dynamicsRiemann solverComputer Science ApplicationsComputational MathematicsSupernovasymbols.namesakeClassical mechanicsModeling and SimulationGravitational collapsesymbolsCircular symmetryStellar evolutionJournal of Computational Physics
researchProduct

Systèmes hyperboliques d'équations aux dérivées partielles linéaires : régularité et matrices diagonalisables

2001

Resume La regularite des solutions d'un systeme d'equations aux derivees partielles hyperbolique, est liee aux proprietes spectrales d'un faisceaux de matrices reelles. Nous nous interessons ici a la regularite L 2 . Celle ci est obtenue si et seulement si l'exponentielle imaginaire du faisceau est bornee. Nous regardons le lien entre cette condition et les proprietes spectrales du faisceau, ici diagonalisable sur R . Nous donnons en particulier un critere d'exponentielle bornee si les valeurs propres ne sont pas de multiplicites constantes, et nous montrons que dans le cas des faisceaux engendres par deux matrices 3×3, l'exponentielle est bornee si et seulement si le faisceau est analytiqu…

Cauchy problemPure mathematics[MATH.MATH-HO]Mathematics [math]/History and Overview [math.HO]010102 general mathematics010103 numerical & computational mathematicsGeneral Medicine0101 mathematics01 natural sciencesHyperbolic partial differential equationComputingMilieux_MISCELLANEOUSMathematics
researchProduct

Curvature increases permeability of the plasma membrane for ions, water and the anti-cancer drugs cisplatin and gemcitabine

2019

ABSTRACTIn this work the permeability of a model asymmetric plasma membrane, for ions, water and the anti-cancer drugs cisplatin and gemcitabine is studied by means of all-atom molecular dynamics simulations. It is shown that permeability of the membranes increases from one to three orders of magnitude upon membrane bending depending on the compound and the sign of curvature. Our results show that the membrane curvature is an important factor which should be considered during evaluation of drug translocation.TOC GRAPHICS

Cell Membrane PermeabilityLipid Bilayerslcsh:MedicineAntineoplastic AgentsMolecular Dynamics SimulationCurvature01 natural sciencesDeoxycytidineArticleSupramolecular assemblyIonMembrane bending03 medical and health sciencesComputational biophysics0103 physical sciencesmedicineAnimalsHumanslcsh:Science030304 developmental biologyCisplatinIons0303 health sciences010304 chemical physicsChemistryCell Membranelcsh:RWaterMembrane structure and assemblyGemcitabineOrders of magnitude (mass)MembraneMembrane curvaturePermeability (electromagnetism)Drug deliveryBiophysicslcsh:QCisplatinmedicine.drugScientific Reports
researchProduct

Application of patient derived liver cancer cell lines for phenotypic characterization and therapeutic target identification

2018

Cell cultureGastroenterologymedicineIdentification (biology)Computational biologyBiologyLiver cancermedicine.diseasePhenotypeZeitschrift für Gastroenterologie
researchProduct

Toward minimal bacterial cells: evolution vs. design.

2008

Abstract Recent technical and conceptual advances in the biological sciences opened the possibility of the construction of newly designed cells. In this paper we review the state of the art of cell engineering in the context of genome research, paying particular attention to what we can learn on naturally reduced genomes from either symbiotic or free living bacteria. Different minimal hypothetically viable cells can be defined on the basis of several computational and experimental approaches. Projects aiming at simplifying living cells converge with efforts to make synthetic genomes for minimal cells. The panorama of this particular view of synthetic biology lead us to consider the use of d…

Cell engineeringContext (language use)BiologyMicrobiologyGenomeArticleEvolution MolecularSynthetic biologyGenome researchGenes SyntheticBiological sciencesreduced genomesEvolution ChemicalBacteriasynthetic cellbusiness.industrysynthetic genomeComputational BiologyBiotechnologyInfectious DiseasesMinimal genomeBiochemical engineeringsynthetic biologybusinessFree living bacteriaGenome Bacterialminimal genomeFEMS microbiology reviews
researchProduct

A Bimolecular Multicelular complementation system for the detection of syncytium formation: A new methodology for the identification of entry inhibit…

2019

AbstractFusion of viral and cellular membranes is a key step during the viral life cycle. Enveloped viruses trigger this process by means of specialized viral proteins expressed on their surface, the so called viral fusion proteins. There are multiple assays to analyze the viral entry including those that focus on the cell-cell fusion induced by some viral proteins. These methods often rely on the identification of multinucleated cells (syncytium) as a result of cell membrane fusions. In this manuscript, we describe a novel methodology for the study of cell-cell fusion. Our approach, named Bimolecular Multicelular Complementation (BiMuC), provides an adjustable platform to investigate quali…

Cell membraneComplementationSyncytiummedicine.anatomical_structureViral envelopeViral life cycleChemistryViral entryDrug discoveryvirusesmedicineComputational biologySmall molecule
researchProduct

Comparative analysis of virtual screening approaches in the search for novel EphA2 receptor antagonists

2015

The EphA2 receptor and its ephrin-A1 ligand form a key cell communication system, which has been found overexpressed in many cancer types and involved in tumor growth. Recent medicinal chemistry efforts have identified bile acid derivatives as low micromolar binders of the EphA2 receptor. However, these compounds suffer from poor physicochemical properties, hampering their use in vivo. The identification of compounds able to disrupt the EphA2-ephrin-A1 complex lacking the bile acid scaffold may lead to new pharmacological tools suitable for in vivo studies. To identify the most promising virtual screening (VS) protocol aimed at finding novel EphA2 antagonists, we investigated the ability of…

Cell signalingDatabases Pharmaceuticaldrug designPharmaceutical ScienceComputational biologyBiologyCrystallography X-RayMolecular Docking SimulationArticleAnalytical Chemistrylcsh:QD241-441Structure-Activity RelationshipUser-Computer Interfacelcsh:Organic chemistryPPI inhibitorsDrug Discoveryshape screeningStructure–activity relationshipPhysical and Theoretical ChemistryReceptorProtein Kinase InhibitorsVirtual screeningMolecular StructureDrug discoveryReceptor EphA2EphA2 antagonistOrganic ChemistryEphrin-A1virtual screeningEPH receptor A2C700Combinatorial chemistryMolecular Docking SimulationUniPR129Chemistry (miscellaneous)Docking (molecular)dockingMolecular Medicinepharmacophore search
researchProduct

Systems Biology and Stem Cell Pluripotency: Revisiting the Discovery of Induced Pluripotent Stem Cell

2016

Recent breakthroughs in stem cell biology have accelerated research in the area of regenerative medicine. Over the past years, it has become possible to derive patient-specific stem cells which can be used to generate different cell populations for potential cell therapy. Systems biological modeling of stem cell pluripotency and differentiation have largely been based on prior knowledge of signaling pathways, gene regulatory networks, and epigenetic factors. However, there is a great need to extend the complexity of the modeling and to integrate different types of data, which would further improve systems biology and its uses in the field. In this chapter, we first give a general background…

Cell therapyCellular differentiationSystems biologyComputational biologyBiologyStem cellInduced pluripotent stem cellCell potencyEmbryonic stem cellRegenerative medicine
researchProduct

Computational identification of cell-specific variable regions in ChIP-seq data.

2019

ABSTRACT Chromatin immunoprecipitation followed by sequencing (ChIP-seq) is used to identify genome-wide DNA regions bound by proteins. Several sources of variation can affect the reproducibility of a particular ChIP-seq assay, which can lead to a misinterpretation of where the protein under investigation binds to the genome in a particular cell type. Given one ChIP-seq experiment with replicates, binding sites not observed in all the replicates will usually be interpreted as noise and discarded. However, the recent discovery of high-occupancy target (HOT) regions suggests that there are regions where binding of multiple transcription factors can be identified. To investigate these regions,…

Cell typeAcademicSubjects/SCI00010Computational biologyPlasma protein bindingBiologyGenomeCell LineEvolution Molecular03 medical and health scienceschemistry.chemical_compoundMice0302 clinical medicineNarese/3Cell Line TumorGeneticsAnimalsHumansEpigeneticsBinding sitePromoter Regions GeneticTranscription factorEmbryonic Stem Cells030304 developmental biology0303 health sciencesPrincipal Component AnalysisBinding SitesNucleotidesGenetic VariationPromoterGenomicsChromatinchemistryCpG siteMCF-7 CellsChromatin Immunoprecipitation SequencingMethods OnlineR-Loop StructuresK562 CellsChromatin immunoprecipitation030217 neurology & neurosurgeryFunction (biology)DNATranscription FactorsNucleic acids research
researchProduct

Graph-based characterisations of cell types and functionally related modules in promoter capture Hi-C Data

2019

Cell typeComputer scienceGraph basedComputational biology
researchProduct