Search results for "kinetics"

showing 10 items of 2224 documents

Substrate Selectivity of Coumarin Derivatives by Human CYP1 Enzymes: In Vitro Enzyme Kinetics and In Silico Modeling

2021

Of the three enzymes in the human cytochrome P450 family 1, CYP1A2 is an important enzyme mediating metabolism of xenobiotics including drugs in the liver, while CYP1A1 and CYP1B1 are expressed in extrahepatic tissues. Currently used CYP substrates, such as 7-ethoxycoumarin and 7-ethoxyresorufin, are oxidized by all individual CYP1 forms. The main aim of this study was to find profluorescent coumarin substrates that are more selective for the individual CYP1 forms. Eleven 3-phenylcoumarin derivatives were synthetized, their enzyme kinetic parameters were determined, and their interactions in the active sites of CYP1 enzymes were analyzed by docking and molecular dynamic simulations. All cou…

entsyymitStereochemistryGeneral Chemical EngineeringCYP1B1Articlechemistry.chemical_compoundheterocyclic compoundsEnzyme kineticsQD1-999chemistry.chemical_classificationbiologysytokromitChemistryCYP1A2Substrate (chemistry)Active sitelääkeaineetGeneral Chemistryrespiratory systemCoumarinChemistrylääkkeetEnzymeDocking (molecular)biology.proteinbiolääketiedeACS Omega
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External evaluation of population pharmacokinetic models of vancomycin in neonates: the transferability of published models to different clinical set…

2012

AimsVancomycin is one of the most evaluated antibiotics in neonates using modeling and simulation approaches. However no clear consensus on optimal dosing has been achieved. The objective of the present study was to perform an external evaluation of published models, in order to test their predictive performances in an independent dataset and to identify the possible study-related factors influencing the transferability of pharmacokinetic models to different clinical settings.MethodPublished neonatal vancomycin pharmacokinetic models were screened from the literature. The predictive performance of six models was evaluated using an independent dataset (112 concentrations from 78 neonates). T…

external evaluationpopulation pharmacokineticsvancomycindosing regimenneonatesserum creatinine
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Modeling the influence of potassium content and heating rate on biomass pyrolysis

2017

This study presents a combined kinetic and particle model that describes the effect of potassium and heating rate during the fast pyrolysis of woody and herbaceous biomass. The model calculates the mass loss rate, over a wide range of operating conditions relevant to suspension firing. The shrinking particle model considers internal and external heat transfer limitations and incorporates catalytic effects of potassium on the product yields. Modeling parameters were tuned with experimentally determined char yields at high heating rates (>200 K s−1) using a wire mesh reactor, a single particle burner, and a drop tube reactor. The experimental data demonstrated that heating rate and potassium …

fast pyrolysisParticle modelheating rate020209 energyPotassiumchemistry.chemical_elementBiomass02 engineering and technologyManagement Monitoring Policy and LawEnergy engineeringMetaplast0202 electrical engineering electronic engineering information engineeringmetaplastWaste managementpotassiumMechanical EngineeringHerbaceous biomassBuilding and ConstructionHeating ratePulp and paper industryKineticsGeneral EnergychemistrykineticsHeat transferPotassiumParticle sizePyrolysisFast pyrolysis
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SIA “Kinetics Nail Systems” uzņēmējdarbības riski, finanšu analīze un novērtējums turpmākai uzņēmuma attīstībai

2019

Diplomdarba tēma ir “SIA “Kinetics Nail Systems” uzņēmējdarbības riski, finanšu analīze un novērtējums turpmākai uzņēmuma attīstībai”. Darbu veido ievads, trīs nodaļas, secinājumi un priekšlikumi. Diplomdarba mērķis ir apkopot uzņēmējdarbības risku un finanšu analīzes teorētiskos aspektus, lai veiktu SIA “Kinetics Nail Systems” uzņēmējdarbības risku novērtēšanu, finanšu analīzi, par iegūtajiem rezultātiem izdarītu secinājumus un izstrādātu priekšlikumus turpmākai uzņēmuma attīstībai. Darba izstrādes rezultātā secināts, ka SIA “Kinetics Nail Systems” ir pakļauts vairākiem uzņēmējdarbības riskiem, kā arī uzņēmuma finansiālais stāvoklis ir stabils, bet to iespējams uzlabot. Risku novēršanai un…

finanšu analīzeEkonomikaKinetics Nail Systemsuzņēmējdarbības riskiuzņēmuma attīstība
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Physical chemical properties and kinetics of redox processes in water/soybean oil microemulsions

2008

Microemulsoes de agua em oleo (ME w/o) constituidas de agua, oleo de soja, SDS (dodecil sulfato de sodio) e diversos alcoois de cadeia curta foram caracterizadas sob o ponto de vista fisico-quimico e de propriedades eletroanaliticas. Foram testados diferentes co-surfactantes e razoes surfactante:cosurfactante, sendo a ME com a composicao mais favoravel utilizada para estudar a cinetica de processos redox. Para tanto, realizaram-se medidas de voltametria ciclica utilizando como eletrodo de trabalho um ultramicroeletrodo de disco de Pt e, como eletrodo de referencia e auxiliar, foram usados Ag/AgCl e Pt, respectivamente, e ferroceno como uma sonda. Verificou-se que a estabilidade termodinâmic…

food.ingredientAqueous solutionChemistryStereochemistryKineticsGeneral ChemistryReference electrodeRedoxSoybean oilchemistry.chemical_compoundfoodMicroemulsionSodium dodecyl sulfateCyclic voltammetryNuclear chemistryJournal of the Brazilian Chemical Society
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Sorption kinetic of aroma compounds by edible bio-based films from marine-by product macromolecules: Effect of relative humidity conditions

2019

International audience; Edible films based on gelatin and chitosan have high gas and aroma barrier properties. This study focused on their capability to sorbed/retain aroma compounds (1-hexanal, 2-hexen-1-ol, 1-hexanol, 3-hexanone and phenol) at three relative humidity level (≤2%, 53% or 84% RH). Whatever the relative humidity condition, the order of sorption is keton (3-hexanone) < aldehyde (1-hexanal) < aliphatic alcohols (2-hexen-1-ol and 1-hexanol) < phenol. This order could be related to the intrinsic chemical properties of aroma compounds. The increase in moisture enhanced the sorption at the highest RH for all the aroma compounds. However, a competition between water and aliphatic al…

food.ingredientChromatography GasAntiplasticization030309 nutrition & dieteticsActive edible filmsGelatinStructure propertiesAnalytical Chemistry03 medical and health scienceschemistry.chemical_compound0404 agricultural biotechnologyfood[SDV.IDA]Life Sciences [q-bio]/Food engineeringPhenolRelative humidityAroma0303 health sciencesChitosanVolatile Organic CompoundsAroma sorptionMoisturebiologyCalorimetry Differential ScanningPhenolChemistryPlasticizationPlasticizerTemperatureSorptionHumidity04 agricultural and veterinary sciencesGeneral MedicineKetonesbiology.organism_classification040401 food scienceKinetics13. Climate actionAlcoholsGelatinAdsorptionGlass transitionGlass transitionFood ScienceNuclear chemistry
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Flavour release at the interfaces of stirred fruit yoghurt models

2006

Abstract Model matrices consisting of a pectin and a dairy gel were investigated to study the transfer of flavour compounds between the different phases of stirred fruit yoghurt. Using a full factorial experimental design, different parameters (storage temperature, initial flavour concentration in the pectin gel and fat content of the dairy gel) were studied. The kinetics of the migration of flavour compounds between the two gels were investigated using a novel SPME method, where a Carboxen/Polydimethylsiloxane fibre was directly inserted into the pectin gel. Flavour compounds were predominantly retained in the pectin gel and thus, the presence of fat in the dairy gel did not affect their t…

food.ingredientChromatographyPectinbiologyPolydimethylsiloxaneChemistryFat contentFlavourKineticsfood and beveragesbiology.organism_classificationchemistry.chemical_compoundFactorial experimental designfoodFood scienceAroma
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Effects of heat treatment and acid-induced gelation on aroma release from flavoured skim milk

2010

Abstract Time dependent aroma release was studied in skim milk, heated skim milk as well as in acid-induced gels derived from them using static headspace – gas chromatography analysis. A variable order kinetic model was fitted to experimental data and was used to determine headspace equilibrium concentration and initial rates of release. When compared to water, retention in milk based matrices was increased for hydrophobic aroma compounds, while it was decreased for more hydrophilic volatiles. Acid gelation reduced the initial rate of aroma release by a factor varying from 2.0 to 3.8, depending on the compound. Positive deviation from the first order kinetics was observed and suggests that …

food.ingredientChromatographybiologyChemistryChemical structureKineticsFlavourfood and beveragesGeneral Medicinebiology.organism_classificationAnalytical Chemistrychemistry.chemical_compoundfluids and secretionsfoodSkimmed milkAroma compoundGas chromatographyVolatility (chemistry)AromaFood ScienceFood Chemistry
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Retention/release equilibrium of aroma compounds in fat-free dairy gels

2010

BACKGROUND: The replacement of fat by thickeners in fat-free yoghurts leads to an important modification of aroma compound partitioning, with an impact on aroma perception. Investigation of retention/release equilibria allows a good understanding of aroma compound behaviour depending on food composition. RESULTS: Vapour/liquid equilibria of ten aroma compounds (two esters, two ketones, three aldehydes and three alcohols) in several media were studied to investigate the influence of pectin addition to fat-free dairy gel on the retention/release equilibrium. The partition coefficient of each aroma compound was measured by headspace analysis at equilibrium in six media (pure water, low-methoxy…

food.ingredientPectinPolysaccharide01 natural sciencesPhase TransitionDAIRY GELchemistry.chemical_compound0404 agricultural biotechnologyfoodPECTINAROMA RELEASE[SDV.IDA]Life Sciences [q-bio]/Food engineeringAroma compoundFood scienceAromaHYDROPHOBICITYchemistry.chemical_classificationVolatile Organic CompoundsNutrition and DieteticsChromatographyAqueous mediumbiologyFood additive010401 analytical chemistryfood and beveragesFood composition data04 agricultural and veterinary sciencesbiology.organism_classificationDietary Fats040401 food science0104 chemical sciencesPartition coefficientKineticschemistryPectinsDairy ProductsGelsHydrophobic and Hydrophilic InteractionsAgronomy and Crop ScienceFood ScienceBiotechnologyJournal of the Science of Food and Agriculture
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Effect of cytochrome P450 inhibitors (diethyl dithiocarbamate, ketoconazole and grapefruit juice) on the pharmacokinetics of all-trans-retinoic acid.

2004

Diethyl dithiocarbamate (DEDTC) has been reported to be a more powerful inhibitor of all-trans-retinoic acid (ATRA) in vitro metabolism than the well-established cytochrome P450 (CYP) inhibitor ketoconazole (KC). In recent years grapefruit juice (GJ) has been shown to be able to increase the oral bioavailability of several drugs by inhibiting intestinal CYP. This study investigated the in vivo effect of these CYP inhibitors on the pharmacokinetics of ATRA. The latter was administered to rats as a constant-rate intravenous (i.v.) infusion (0.48 mg h(-1) kg(-1)) during 10 h and orally (1.6 mg kg(-1)). DEDTC (320 mg kg(-1) x 2 i.v., 6.4 and 32 mg kg(-1) per os (p.o.)) did not change the ATRA c…

food.ingredientRetinoic acidPharmaceutical ScienceTretinoinPharmacologyGrapefruit juiceBeverageschemistry.chemical_compoundfoodPharmacokineticsCytochrome P-450 Enzyme SystemIn vivoDrug DiscoverymedicineAnimalsCytochrome P-450 Enzyme InhibitorsEnzyme InhibitorsneoplasmsCytochrome P-450 Enzyme Inhibitorsbiologyorganic chemicalsCytochrome P450BioavailabilityRatsKetoconazolechemistrybiology.proteinKetoconazoleDitiocarbmedicine.drugCitrus paradisiFarmaco (Societa chimica italiana : 1989)
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