Search results for "41"

showing 10 items of 3365 documents

Self-assembly of metallosupramolecular rhombi from chiral concave 9,9'-spirobifluorene-derived bis(pyridine) ligands.

2014

Two new 9,9’-spirobifluorene-based bis(4-pyridines) were synthesised in enantiopure and one also in racemic form. These ligands act as concave templates and form metallosupramolecular [(dppp)2M2L2] rhombi with cis-protected [(dppp)Pd]2+ and [(dppp)Pt]2+ ions. The self-assembly process of the racemic ligand preferably occurs in a narcissistic self-recognising manner. Hence, a mixture of all three possible stereoisomers [(dppp)2M2{(R)-L}2](OTf)4, [(dppp)2M2{(S)-L}2](OTf)4, and [(dppp)2M2{(R)-L}{(S)-L}](OTf)4 was obtained in an approximate 1.5:1.5:1 ratio which corresponds to an amplification of the homochiral assemblies by a factor of approximately three as evidenced by NMR spectroscopy and m…

Stereochemistryconcave templatesSupramolecular chemistrymetal complexesFull Research Paperself-sortingsupramolecular chemistrylcsh:QD241-441lcsh:Organic chemistrysupramolekulaarinen kemialcsh:Scienceta1169LigandChemistryOrganic ChemistryNuclear magnetic resonance spectroscopyself-assemblyPyridine ligandCrystallographyChemistrySelf sortingEnantiopure drug99’-spirobifluorenelcsh:QSelf-assembly9’-spirobifluoreneSingle crystalBeilstein journal of organic chemistry
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N-Benzyl Residues as the P1′ Substituents in Phosphorus-Containing Extended Transition State Analog Inhibitors of Metalloaminopeptidases

2020

Peptidyl enzyme inhibitors containing an internal aminomethylphosphinic bond system (P(O)(OH)-CH2-NH) can be termed extended transition state analogs by similarity to the corresponding phosphonamidates (P(O)(OH)-NH). Phosphonamidate pseudopeptides are broadly recognized as competitive mechanism-based inhibitors of metalloenzymes, mainly hydrolases. Their practical use is, however, limited by hydrolytic instability, which is particularly restricting for dipeptide analogs. Extension of phosphonamidates by addition of the methylene group produces a P-C-N system fully resistant in water conditions. In the current work, we present a versatile synthetic approach to such modified dipeptides, based…

Stereochemistryenzyme inhibitorsPharmaceutical Scienceorganophosphorus compoundsPhosphinateArticleAnalytical Chemistrylcsh:QD241-44103 medical and health scienceschemistry.chemical_compoundHydrolysis0302 clinical medicinelcsh:Organic chemistryTransition state analogpeptide analogsDrug DiscoveryCarboxylatePhysical and Theoretical ChemistryMethylene030304 developmental biologychemistry.chemical_classification0303 health sciencesDipeptideOrganic Chemistryligand-enzyme interactionsmolecular modeling and dockingEnzymechemistryChemistry (miscellaneous)030220 oncology & carcinogenesisMolecular MedicineLeucineMolecules
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Estigmatización de la obesidad: un problema a erradicar

2021

StereotypingRC620-627Nutrition and DieteticsNutrition. Foods and food supplyObesidadEstereotipoStigmatizationTX341-641EnfermeríaObesityNutritional diseases. Deficiency diseasesPsychologyFood ScienceEstigmatización
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Diffusion of ionic and non-ionic contrast agents in articular cartilage with increased cross-linking--contribution of steric and electrostatic effect…

2013

Abstract Objective To investigate the effect of threose-induced collagen cross-linking on diffusion of ionic and non-ionic contrast agents in articular cartilage. Design Osteochondral plugs (O=6mm) were prepared from bovine patellae and divided into two groups according to the contrast agent to be used in contrast enhanced computed tomography (CECT) imaging: (I) anionic ioxaglate and (II) non-ionic iodixanol. The groups I and II contained 7 and 6 sample pairs, respectively. One of the paired samples served as a reference while the other was treated with threose to induce collagen cross-linking. The equilibrium partitioning of the contrast agents was imaged after 24h of immersion. Fixed char…

Steric effectsCartilage ArticularStatic ElectricityBiomedical EngineeringBiophysicsIonic bondingContrast Mediata3111Diffusionchemistry.chemical_compoundmedicineAnimalsPentosidineta315PyridinolinebiologyThreoseCartilageta3141Iodixanolmedicine.anatomical_structureProteoglycanchemistrybiology.proteinBiophysicsCattleCollagenTomography X-Ray ComputedBiomedical engineeringmedicine.drugMedical engineeringphysics
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Unveiling the Ionic Diels-Alder Reactions within the Molecular Electron Density Theory

2021

The ionic Diels–Alder (I-DA) reactions of a series of six iminium cations with cyclopentadiene have been studied within the Molecular Electron Density Theory (MEDT). The superelectrophilic character of iminium cations, ω &gt

Steric effectsCyclopentadienePharmaceutical ScienceIonic bonding010402 general chemistry01 natural sciencesArticleAnalytical Chemistrychemistry.chemical_compoundQD241-441Computational chemistryDrug Discoveryionic Diels–Alder reactionsReactivity (chemistry)Physical and Theoretical Chemistryorganic_chemistry010405 organic chemistryChemistryOrganic ChemistrySolvationCationic polymerizationMolecular Electron Density TheoryIminiumiminium cationsElectron localization function3. Good health0104 chemical sciencesChemistry (miscellaneous)asynchronicityglobal electron density transfersuperelectrophilesMolecular Medicine
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Valence Topological Charge-Transfer Indices for Reflecting Polarity: Correction for Heteromolecules

2005

Valence topological charge-transfer (CT) indices are applied to the calculation of dipole moments mu. The mu calculated by algebraic and vector semisums of the CT indices are defined. The model is generalized for molecules with heteroatoms and corrected for sp(3)-heteromolecules. The ability of the indices for the description of the molecular charge distribution is established by comparing them with mu of the valence-isoelectronic series of cyclopentadiene, benzene and styrene. Two CT indices, mu(vec) (vector semisum of vertex-pair mu) and mu(vec)V (valence mu(vec)) are proposed. The mu(vec) behaviour is intermediate between mu(vec) and mu(experiment). The correction is produced in the corr…

Steric effectsHeteroatomBiophysicsPharmaceutical ScienceElectronsFluorescence PolarizationMolecular physicsArticleBiophysical PhenomenaAnalytical ChemistryValence topological charge-transfer indexElectronegativitylcsh:QD241-441Atomic orbitallcsh:Organic chemistryHeterocyclic CompoundsReference ValuesComputational chemistryDrug DiscoveryCharge distributionPhysical and Theoretical ChemistryTopological quantum numberDipole momentValence (chemistry)ChemistryOrganic ChemistryCharge densityBenzeneModels TheoreticalDipoleChemistry (miscellaneous)HeteroatomMolecular MedicineIsolelectroic seriesMolecules
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Steviol glycosides and bioactive compounds of a beverage with exotic fruits and Stevia rebaudiana Bert. as affected by thermal treatment

2020

The aim of this study was to investigate the effects of thermal processing on physicochemical properties, steviol glycosides, bioactive compounds, and antioxidant capacity degradation of a beverage based on exotic fruit juices, orange juice, açaí, and oat and sweetened with Stevia rebaudiana water extracts at different concentrations. The experimental design comprised a response surface methodology according to a central composite face-centered design. The variable ranges were 60–99°C, 0.25–15 min, 0–2.5% Stevia percentage. This design was used to determine the optimal thermal processing-Stevia concentration in order to obtain the best retention of bioactive compounds and physicochemical pr…

Steviollcsh:TX341-641Thermal treatmentphysicochemical properties01 natural scienceschemistry.chemical_compound0404 agricultural biotechnologyFood sciencethermal processingsteviol glycosideschemistry.chemical_classificationbioactive compoundslcsh:TP368-456stevia rebaudiana bertoni010401 analytical chemistryGlycoside04 agricultural and veterinary sciences040401 food science0104 chemical sciencesStevia rebaudianaAntioxidant capacitylcsh:Food processing and manufacturechemistrytotal antioxidant capacityexotic fruitslcsh:Nutrition. Foods and food supplyFood ScienceInternational Journal of Food Properties
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Ketogenic diet does not affect strength performance in elite artistic gymnasts

2012

Abstract Background Despite the increasing use of very low carbohydrate ketogenic diets (VLCKD) in weight control and management of the metabolic syndrome there is a paucity of research about effects of VLCKD on sport performance. Ketogenic diets may be useful in sports that include weight class divisions and the aim of our study was to investigate the influence of VLCKD on explosive strength performance. Methods 8 athletes, elite artistic gymnasts (age 20.9 ± 5.5 yrs) were recruited. We analyzed body composition and various performance aspects (hanging straight leg raise, ground push up, parallel bar dips, pull up, squat jump, countermovement jump, 30 sec continuous jumps) before and after…

Straight leg raisemedicine.medical_specialtyWeight lossSports medicinemedicine.medical_treatmentGymnasticlcsh:TX341-641Clinical nutritionBody compositionWeight loAnimal scienceWeight lossmedicineNutrition and DieteticVery low carbohydrate Ketogenic dietlcsh:Sports medicineNutrition and Dieteticsbiologymedicine.diagnostic_testAthletesbusiness.industrybiology.organism_classificationPush-upBiochemistryStrengthmedicine.symptombusinesslcsh:RC1200-1245lcsh:Nutrition. Foods and food supplyKetogenic dietDietingResearch ArticleFood ScienceJournal of the International Society of Sports Nutrition
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"Table 1" of "Cross Sections for the Reactions e+e- --> K+ K- pi+pi-, K+ K- pi0pi0, and K+ K- K+ K- Measured Using Initial-State Radiation Events"

2013

The cross section for the reaction E+ E- --> K+ K- PI+ PI- measured with ISR data. Statistical errors only.

Strange productionE+ E- ScatteringIntegrated Cross SectionE+ E- --> K+ K- PI+ PI-Exclusive1.4125-4.9875Cross SectionSIG
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"Table 1" of "The $e^+ e^-\to K^+ K^- \pi^+\pi^-$, $K^+ K^- \pi^0\pi^0$ and $K^+ K^- K^+ K^-$ Cross Sections Measured with Initial-State Radiation"

2007

Measurement of the E+ E- --> K+ K- PI+ PI- cross section. Statistical errors only.

Strange productionE+ E- ScatteringIntegrated Cross SectionE+ E- --> K+ K- PI+ PI-Exclusive1.413-4.987Cross SectionSIG
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