An operator-valued Tb theorem

We establish conditions similar to the Tb theorem of David, Journé and Semmes which guarantee the boundedness of an integral transformation T with L(X)-valued kernel on , where 1<p<∞ and X is a Banach space with the unconditionality property of martingale differences (UMD).     

Population of nonnative states of lysozyme variants drives amyloid fibril formation

The propensity of protein molecules to self-assemble into highly ordered, fibrillar aggregates lies at the heart of understanding many disorders ranging from Alzheimer's disease to systemic lysozyme amyloidosis. In this paper we use highly accurate kinetic measurements of amyloid fibril growth in combination with spectroscopic tools to quantify the effect of modifications in solution conditions and in the amino acid sequence of human lysozyme on its propensity to form amyloid fibrils under acidic conditions. We elucidate and quantify the correlation between the rate of amyloid growth and the population of nonnative states, and we show that changes in amyloidogenicity are almost entirely due to alterations in the stability of the native state, while other regions of the global free-energy surface remain largely unmodified. These results provide insight into the complex dynamics of a macromolecule on a multidimensional energy landscape and point the way for a better understanding of amyloid diseases.     

Multiobjective muffler shape optimization with hybrid acoustics modeling

This paper considers the combined use of a hybrid numerical method for the modeling of acoustic mufflers and a genetic algorithm for multiobjective optimization. The hybrid numerical method provides accurate modeling of sound propagation in uniform waveguides with non-uniform obstructions. It is based on coupling a wave based modal solution in the uniform sections of the waveguide to a finite element solution in the non-uniform component. Finite element method provides flexible modeling of complicated geometries, varying material parameters, and boundary conditions, while the wave based solution leads to accurate treatment of non-reflecting boundaries and straightforward computation of the transmission loss (TL) of the muffler. The goal of optimization is to maximize TL at multiple frequency ranges simultaneously by adjusting chosen shape parameters of the muffler. This task is formulated as a multiobjective optimization problem with the objectives depending on the solution of the simulation model. NSGA-II genetic algorithm is used for solving the multiobjective optimization problem. Genetic algorithms can be easily combined with different simulation methods, and they are not sensitive to the smoothness properties of the objective functions. Numerical experiments demonstrate the accuracy and feasibility of the model-based optimization method in muffler design.     

Kramers-Kronig analysis on the real refractive index of porous media in the terahertz spectral range

We present a terahertz time-domain experimental technique for the detection of scattering from porous media. The method for detection of the scattering enables one to make a decision when Fresnel or Kramers-Kronig (K-K) analysis can be applied for a porous medium. In this study the real refractive index of a tablet is calculated using the conventional K-K dispersion relation and also using a singly subtractive K-K relation, which are applied to the extinction coefficient obtained from the Beer-Lambert law. The advantage of the K-K analysis is that one gets estimates both for absolute refractive index and also dispersion of the porous tablet, whereas Fresnel analysis provides only the absolute value of the index.     

Pointwise convergence of vector-valued Fourier series

We prove a vector-valued version of Carleson’s theorem: let $Y=[X,H]_\theta $ be a complex interpolation space between an unconditionality of martingale differences (UMD) space $X$ and a Hilbert space $H$ . For $p\in (1,\infty )$ and $f\in L^p(\mathbb T ;Y)$ , the partial sums of the Fourier series of $f$ converge to $f$ pointwise almost everywhere. Apparently, all known examples of UMD spaces are of this intermediate form $Y=[X,H]_\theta $ . In particular, we answer affirmatively a question of Rubio de Francia on the pointwise convergence of Fourier series of Schatten class valued functions.     

A damping preconditioner for time-harmonic wave equations in fluid and elastic material

A physical damping is considered as a preconditioning technique for acoustic and elastic wave scattering. The earlier preconditioners for the Helmholtz equation are generalized for elastic materials and three-dimensional domains. An algebraic multigrid method is used in approximating the inverse of damped operators. Several numerical experiments demonstrate the behavior of the method in complicated two-dimensional and three-dimensional domains.     

Multiple‐element spectrometer for non‐resonant inelastic X‐ray spectroscopy of electronic excitations

A multiple‐analyser‐crystal spectrometer for non‐resonant inelastic X‐ray scattering spectroscopy installed at beamline ID16 of the European Synchrotron Radiation Facility is presented. Nine analyser crystals with bending radii R = 1 m measure spectra for five different momentum transfer values simultaneously. Using a two‐dimensional detector, the spectra given by all analysers can be treated individually. The spectrometer is based on a Rowland circle design with fixed Bragg angles of about 88°. The energy resolution can be chosen between 30–2000 meV with typical incident‐photon energies of 6–13 keV. The spectrometer is optimized for studies of valence and core electron excitations resolving both energy and momentum transfer.     

Oligonucleotides Featuring a Covalently Mercurated 6-Phenylcarbazole Residue as High-Affinity Hybridization Probes for Thiopyrimidine-Containing Sequences

Short oligonucleotides incorporating either 1-mercuri-6-phenylcarbazole, 8-mercuri-6-phenylcarbazole, or 1,8-dimercuri-6-phenylcarbazole C-nucleoside in the middle of the chain have been synthesized and studied for their potential as hybridization probes for sequences containing thiopyrimidine nucleobases. All of these oligonucleotides formed very stable duplexes with complementary sequences pairing the organometallic moiety with either 2- or 4-thiothymine. The isomeric monomercurated oligonucleotides were also able to discriminate between 2- and 4-thiothymine based on the different melting temperatures of the respective duplexes. DFT-optimized structures of the most stable mononuclear Hg^II-mediated base pairs featured a coordinated covalent bond between Hg^II and either S2 or S4 and a hydrogen bond between the carbazole nitrogen and N3. The dinuclear Hg^II-mediated base pairs, in turn, were geometrically very similar to the one previously reported to form between 1,8-dimercuri-6-phenylcarbazole and thymine and had one Hg^II ion coordinated to a thio and the other one to an oxo substituent.