Search results for "Derivative"

showing 10 items of 1074 documents

Fractal eigenstates in disordered systems

1990

Abstract The wave functions of the non-interacting electrons in disordered systems described by a tight-binding model with site-diagonal disorder are investigated by means of the inverse participation ratio. The wave functions are shown to be fractal objects. In three-dimensional samples, a critical fractal dimension can be defined for the mobility edge in the band centre, which yields the mobility edge trajectory in the whole energy range in good agreement with previous calculations based on the investigation of the exponentially decaying transmission coefficient.

Statistics and ProbabilityMathematical analysisInverseElectronCondensed Matter PhysicsFractal dimensionsymbols.namesakeFractalFractal derivativesymbolsTransmission coefficientStatistical physicsWave functionHamiltonian (quantum mechanics)MathematicsPhysica A: Statistical Mechanics and its Applications
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Random walk approximation of BSDEs with H{\"o}lder continuous terminal condition

2018

In this paper, we consider the random walk approximation of the solution of a Markovian BSDE whose terminal condition is a locally Hölder continuous function of the Brownian motion. We state the rate of the L2-convergence of the approximated solution to the true one. The proof relies in part on growth and smoothness properties of the solution u of the associated PDE. Here we improve existing results by showing some properties of the second derivative of u in space. peerReviewed

Statistics and Probabilitynumerical schemeHölder conditionSpace (mathematics)01 natural sciences010104 statistics & probabilityMathematics::Probability0101 mathematicsBrownian motionrandom walk approximationSecond derivativeMathematicsstokastiset prosessitSmoothness (probability theory)numeeriset menetelmät010102 general mathematicsMathematical analysisSpeed of convergenceBackward stochastic differential equationsFunction (mathematics)State (functional analysis)Random walk[MATH.MATH-PR]Mathematics [math]/Probability [math.PR]random walk approxi-mationbackward stochastic differential equationsspeed of convergencespeed of convergence MSC codes : 65C30 60H35 60G50 65G99Mathematics - Probability
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Malliavin calculus of Bismut type without probability

2007

We translate in semigroup theory Bismut's way of the Malliavin calculus.

Statistics::TheoryH-derivativeMathematics::Operator AlgebrasProbability (math.PR)General ChemistryType (model theory)Malliavin calculusMalliavin derivativeMathematics::ProbabilityMathematics::K-Theory and HomologyFOS: MathematicsCalculusMathematics::Differential GeometryMathematics - ProbabilityMathematicsProceedings of the Indian Academy of Sciences - Section A
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Steady-state dynamic response of various hysteretic systems endowed with fractional derivative elements

2019

In this paper, the steady-state dynamic response of hysteretic oscillators comprising fractional derivative elements and subjected to harmonic excitation is examined. Notably, this problem may arise in several circumstances, as for instance, when structures which inherently exhibit hysteretic behavior are supplemented with dampers or isolators often modeled by employing fractional terms. The amplitude of the steady-state response is determined analytically by using an equivalent linearization approach. The procedure yields an equivalent linear system with stiffness and damping coefficients which are related to the amplitude of the response, but also, to the order of the fractional derivativ…

Steady state (electronics)Applied MathematicsMechanical EngineeringMathematical analysisLinear systemAerospace EngineeringBilinear interpolationEquations of motionEquivalent linearizationOcean EngineeringFractional derivative01 natural sciencesHysteretic systemDamperFractional calculusNonlinear systemHysteresisControl and Systems Engineering0103 physical sciencesElectrical and Electronic Engineering010301 acousticsSteady-state responseMathematics
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Rethinking Cysteine Protective Groups:S-Alkylsulfonyl-l-Cysteines for Chemoselective Disulfide Formation

2016

The ability to reversibly cross-link proteins and peptides grants the amino acid cysteine its unique role in nature as well as in peptide chemistry. We report a novel class of S-alkylsulfonyl-l-cysteines and N-carboxy anhydrides (NCA) thereof for peptide synthesis. The S-alkylsulfonyl group is stable against amines and thus enables its use under Fmoc chemistry conditions and the controlled polymerization of the corresponding NCAs yielding well-defined homo- as well as block co-polymers. Yet, thiols react immediately with the S-alkylsulfonyl group forming asymmetric disulfides. Therefore, we introduce the first reactive cysteine derivative for efficient and chemoselective disulfide formation…

Stereochemistry010402 general chemistryCleavage (embryo)01 natural sciencesRing-opening polymerizationCatalysisAnhydridesPolymerizationchemistry.chemical_compoundPeptide synthesisCysteineDisulfidesSulfhydryl CompoundsAmineschemistry.chemical_classification010405 organic chemistryOrganic ChemistryGeneral Chemistry0104 chemical sciencesAmino acidchemistryPolymerizationDrug deliveryPeptidesDerivative (chemistry)CysteineChemistry - A European Journal
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Syntheses of Four Enantiomers of 2,3-Diendo- and 3-Endo-aminobicyclo[2.2.2]oct-5-ene-2-exo-carboxylic Acid and Their Saturated Analogues

2013

Abstract: Ethyl 2,3- diendo -3-aminobicyclo[2.2.2]oct- 5-ene-2-carboxylate ((±)- 1 ) was resolved with O , O '-dibenzoyltartaric acid via diastere omeric salt formation. The efficient synthesis of the enantiomers of 2,3- diendo -3-aminobicyclo[2.2.2]oct- 5-ene-2-carboxylic acid ((+)- 7 and (–)- 7 ), 3- endo -aminobicyclo[2.2.2]oct-5-ene-2- exo -carboxylic acid ((+)- 5 and (–)- 5 ), cis - and trans -3-aminobicyclo[2.2.2]octa ne-2-carboxylic acid ((+)- 6 , (–)- 6 , (+)- 8 and (–)- 8 ) was achieved via isomerization, hydrogenation and hydrolysis of the corresponding esters (–)- 1 and (+)- 1 . The stereochemistry and relative configurations of the synthesized compounds were determined by NMR sp…

StereochemistryCarboxylic acidCarboxylic AcidsPharmaceutical ScienceArticleAnalytical Chemistrylcsh:QD241-441Hydrolysislcsh:Organic chemistryDrug DiscoveryMoleculePhysical and Theoretical Chemistryta116Nuclear Magnetic Resonance BiomolecularEne reactionchemistry.chemical_classificationMolecular StructureChemistryOrganic ChemistryDiastereomerresolutionconstrained chiral β-amino acidsEstersNuclear magnetic resonance spectroscopycontinuous flow hydrogenationsChemistry (miscellaneous)bicyclic β-amino acid derivativesMolecular MedicineEnantiomercontinuous flow hydrogenations<b> </b>bicyclic beta-amino acid derivativesIsomerizationconstrained chiral beta-amino acids
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Nitramino, NRNO2 (R = H, CH3), as a substituent.13C and15N NMR spectroscopic study of nitraminobenzenes and -pyridines

1993

In order to clarify the special properties of the aryl-bound nitramino substituent NRNO 2 (R=H, CH 3 ), 13 C and 15 N NMR spectra of six nitraminobenzenes and nine nitraminopyridines were measured in DMSO-d 6 and their chemical shifts assigned. 1 H NMr chemical shifts and spin-spin coupling constants of all the compounds were also determined. In contrast to the behaviour of nitropyridines or -benzenes studied previously, most of the present compounds gave very broad 17 O NMR lines even at elevated temperatures and their 17 O NMR data were not useful for any reliable conclusions

StereochemistryChemical shiftSubstituentGeneral ChemistryNuclear magnetic resonance spectroscopyNmr dataMedicinal chemistryNMR spectra databasechemistry.chemical_compoundchemistryBenzene derivativesProton NMRNitroamineGeneral Materials ScienceMagnetic Resonance in Chemistry
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Annelated pyrrolo-pyrimidines from amino-cyanopyrroles and BMMAs as leads for new DNA-interactive ring systems.

2005

The efficient one-pot synthesis of several new tricyclic systems of type 1 and 2, obtained from the reaction of substituted 2-amino-3-cyanopyrroles and 3-amino-4-cyanopyrroles with BMMAs, is reported. The duration and yields of the reaction strongly depend on the reactivity of the starting pyrrole and on the size of the ring to be formed. Mechanist features of the reaction were investigated and proposed by studying also the reactivity of a 3-aminopyrrole-2,4-dicyano substituted. The method reported represents the first example of the use of BMMA reagents in combination with pyrrole derivatives and allows an easy and versatile entry to a large number of hitherto unknown pyrrolo-pyrimidines f…

StereochemistryClinical BiochemistryPharmaceutical ScienceRing (chemistry)Annelated pyrrolo-pyrimidineBiochemistryChemical synthesisPyrrole derivativeschemistry.chemical_compoundBMMA reagentDrug DiscoveryReactivity (chemistry)PyrrolesMolecular BiologyPyrroleSpectrum AnalysisOrganic ChemistryDNAAmino-cyanopyrroleCombinatorial chemistryPyrimidineschemistryDNA-interactive polycycles.ReagentOne pot reactionMolecular MedicineDNABioorganicmedicinal chemistry
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Enlarging the family of ferrocenylphosphine dinuclear rhodium complexes: synthesis and X-ray structure of a novel “A-frame”-type trimetallic Rh/Fe/Rh…

2004

Abstract The symmetrically substituted ligand 1,1 ′ -bis[di(5-methyl-2-furyl)phosphino]ferrocene ( 1 ) has been obtained from the bromophosphine BrP(Fu Me ) 2 and the dilithioferrocene/TMEDA adduct. The quantitative addition of this ferrocene derivative to the tetracarbonyl dimer [(CO) 4 Rh 2 {μ-(S t Bu) 2 }] leads, through decarbonylation, to the dinuclear rhodium complex [(CO) 2 Rh 2 {μ-(S t Bu) 2 }{μ- P , P -Fc[P(Fu Me ) 2 ] 2 }] ( 2 ) in high yield. A X-ray structure [ orthorhombic , space group P 2 1 2 1 2 1 ; a =11.2982(2) A, b =13.3165(3) A, c =27.2687(7) A] and the solution multinuclear NMR characterization are reported, which show that the rare “quasi-closed bridging” A-frame struc…

StereochemistryDimerDecarbonylationX-raychemistry.chemical_elementRhodiumAdductInorganic Chemistrychemistry.chemical_compoundCrystallographychemistryFerroceneMaterials ChemistryOrthorhombic crystal systemFerrocene derivativesPhysical and Theoretical ChemistryInorganica Chimica Acta
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Recognition of Li+ by a Salophen−UO2 Homodimeric Complex

2009

Self-assembly via mutual U-coordination of the salophen-UO(2) complex 1 creates a dimeric species which is shown to be useful for metal binding. Indeed, the 1 dimer has affinity for alkali metal cations and, interestingly, a marked selectivity for Li(+), determined by electrospray ionization mass spectrometry and (1)H NMR techniques. X-ray diffraction helped in the elucidation of the dimeric complex structure, which presents a crown-ether-type coordination site, in analogy to the more familiar 12-crown-4, responsible for the metal interaction. Comparison with isomer 2, and the salen derivative 3, increases the understanding of the behavior of such systems in solution and in the solid state.

StereochemistryDimerElectrospray ionizationSolid-stateAlkali metalInorganic ChemistryMetalchemistry.chemical_compoundCrystallographychemistryvisual_artProton NMRvisual_art.visual_art_mediumPhysical and Theoretical ChemistrySelectivityDerivative (chemistry)Inorganic Chemistry
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