Search results for "dynamic effects"

showing 6 items of 6 documents

OP09.10: Hemodynamic effects of sildenafil administration in an animal model of preeclampsia

2011

Radiological and Ultrasound Technologybusiness.industrySildenafilObstetrics and GynecologyGeneral Medicinemedicine.diseasePreeclampsiachemistry.chemical_compoundAnimal modelReproductive MedicinechemistryAnesthesiaMedicineRadiology Nuclear Medicine and imagingbusinessAdministration (government)Hemodynamic effectsUltrasound in Obstetrics & Gynecology
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Minimization of dynamic effects in the evolution of dihydrofolate reductase

2015

Protein isotope labeling is a powerful technique to probe functionally important motions in enzyme catalysis and can be applied to investigate the conformational dynamics of proteins.

0301 basic medicineStereochemistry010402 general chemistrymedicine.disease_causeenzyme catalysis01 natural sciencesEnzyme catalysisCatalysis03 medical and health sciencesdihydrofolate reductaseDihydrofolate reductaseEscherichia colimedicineQDdynamic effectsEscherichia colichemistry.chemical_classification030102 biochemistry & molecular biologybiologyThermophilefungifood and beveragesGeneral Chemistry0104 chemical sciencesChemistryEnzymechemistryMoritella profundabiology.proteinBiophysicsMesophileChemical Science
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Quantifying the limits of transition state theory in enzymatic catalysis

2017

Significance Transition state theory (TST) is the most popular theory to calculate the rates of enzymatic reactions. However, in some cases TST could fail due to the violation of the nonrecrossing hypothesis at the transition state. In the present work we show that even for one of the most controversial enzymatic reactions—the hydride transfer catalyzed by dihydrofolate reductase—the error associated to TST represents only a minor correction to the reaction rate. Moreover, this error is actually larger for the reaction in solution than in the enzymatic active site. Based on this finding and on previous studies we propose an “enzymatic shielding” hypothesis which encompasses various aspects …

Surface (mathematics)enzymatic catalysisDegrees of freedom (statistics)Molecular Dynamics Simulation010402 general chemistry01 natural sciencesEnzyme catalysisReaction coordinateReaction rateTransition state theoryMolecular dynamicsdihydrofolate reductasetransmission coefficientComputational chemistry0103 physical sciencesHumansdynamic effectsStatistical physicsIonsMultidisciplinary010304 chemical physicsChemistryState (functional analysis)Biological Sciencesbacterial infections and mycoses0104 chemical sciencesChemistryBiophysics and Computational BiologyKineticsTetrahydrofolate Dehydrogenasetransition state theoryPhysical SciencesBiocatalysisProceedings of the National Academy of Sciences
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Do dynamic effects play a significant role in enzymatic catalysis? A theoretical analysis of formate dehydrogenase.

2010

A theoretical study of the protein dynamic effects on the hydride transfer between the formate anion and nicotinamide adenine dinucleotide (NAD + ), catalyzed by formate dehydrogenase (FDH), is presented in this paper. The analysis of free downhill molecular dynamic trajectories, performed in the enzyme and compared with the reaction in aqueous solution, has allowed the study of the dynamic coupling between the reacting fragments and the protein or the solvent water molecules, as well as an estimation of the dynamic effect contribution to the catalytic effect from calculation of the transmission coefficient in the enzyme and in solution. The obtained transmission coefficients for the enzyme…

StereochemistryFDHNicotinamide adenine dinucleotideFormate dehydrogenaseenzyme catalysisChemical reactionrare-event trajectoriesCatalysisEnzyme catalysischemistry.chemical_compoundMolecular dynamicsReaction rate constantGrote–Hynes theoryComputational chemistryFormatedynamic effectsNuclear Magnetic Resonance BiomolecularAqueous solutionMolecular StructureOrganic ChemistryGeneral ChemistryModels TheoreticalNADFormate Dehydrogenasesmolecular dynamicsKineticschemistryAlgorithmsChemistry (Weinheim an der Bergstrasse, Germany)
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Hemodynamic Effects of Ventricular Pacing

1985

Fixed rate ventricular pacing is used in most cases of implanted pacemakers. It does not usually create considerable hemodynamic problems, as the heart, by its adaptation mechanism, is capable of varying its pump performance to meet the metabolic needs[1,3].

medicine.medical_specialtyEjection fractionbusiness.industryInternal medicineStrenuous exerciseModerate exerciseCardiologyMedicineHemodynamicsStroke volumeVentricular pacingbusinessHemodynamic effects
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Behavioral and hemodynamic effects of prefrontal anodal stimulation in healthy older adults: a simultaneous tDCS/fNIRS study

2019

medicine.medical_specialtybusiness.industryGeneral NeuroscienceagingBiophysicsfNIRStDCSworking memorylcsh:RC321-571Physical medicine and rehabilitationMedicineNeurology (clinical)tDCS fNIRS working memory agingAnodal stimulationbusinesslcsh:Neurosciences. Biological psychiatry. NeuropsychiatryHemodynamic effects
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