FPGA成为替代ASIC的最佳选择

多年来,Xilinx公司的可编程逻辑技术始终扮演着ASIC替代解决方案的角色.过去十多年来,每次当ASIC技术实现摩尔定律的预期,Xilinx FPGA和CPLD都迅速填补了由此而留下的间隙.最近,有些ASIC制造商推出了称为结构化ASIC(Structured ASIC)的改进ASIC结构,试图解决与基于标准单元的ASIC和门阵列相关的一些问题.但最终,人们都会问到这一决定性问题,"如果我们需要100万门至500万门的设计,到底哪种技术最佳地结合了硬件、软件和设计支持,从而可最好地满足我们的需要?"     

Activation detection in fMRI using a maximum energy ratio statistic obtained by adaptive spatial filtering

An adaptive spatial filtering method is proposed that takes into account contextual information in fMRI activation detection. This filter replaces the time series of each voxel with a weighted average of time series of a small neighborhood around it. The filter coefficients at each voxel are derived so as to maximize a test statistic designed to indicate the presence of activation. This statistic is the ratio of the energy of the filtered time series in a signal subspace to the energy of the residuals. It is shown that the filter coefficients and the maximum energy ratio can be found through a generalized eigenproblem. This approach equates the filter coefficients to the elements of an eigenvector corresponding to the largest eigenvalue of a specific matrix, while the largest eigenvalue itself becomes the maximum energy ratio that can be used as a statistic for detecting activation. The distribution of this statistic under the null hypothesis is derived by a nonparametric permutation technique in the wavelet domain. Also, in this paper we introduce a new set of basis vectors that define the signal subspace. The space spanned by these basis vectors covers a wide range of possible hemodynamic response functions (HRF) and is applicable to both event related and block design fMRI signal analysis. This approach circumvents the need for a priori assumptions about the exact shape of the HRF. Resting-state experimental fMRI data were used to assess the specificity of the method, showing that the actual false-alarm rate of the proposed method is equal or less than its expected value. Analysis of simulated data and motor task fMRI datasets from six volunteers using the method proposed here showed an improved sensitivity as compared to a conventional test with a similar statistic applied to spatially smoothed data.     

Multiresolution fMRI activation detection using translation invariant wavelet transform and statistical analysis based on resampling

A new method is proposed for activation detection in event-related functional magnetic resonance imaging (fMRI). The method is based on the analysis of selected resolution levels (a subspace) in translation invariant wavelet transform (TIWT) domain. Using a priori knowledge about the activation signal and trends, we analyze their power in different resolution levels in TIWT domain and select an optimal set of resolution levels. A randomization-based statistical test is then applied in the wavelet domain for activation detection. This approach suppresses the effects of trends and enhances the detection sensitivity. In addition, since TIWT is insensitive to signal translations, the power analysis is robust with respect to signal shifts. The randomization test alleviates the need for assumptions about fMRI noise. The method has been applied to simulated and experimental fMRI datasets. Comparisons have been made between the results of the proposed method, a similar method in the time domain and the cross-correlation method. The proposed method has shown superior sensitivity compared to the other methods.     

Ritter-enabled catalytic asymmetric chloroamidation of olefins

Intermolecular asymmetric haloamination reactions are challenging due to the inherently high halenium affinity (HalA) of the nitrogen atom, which often leads to N-halogenated products as a kinetic trap. To circumvent this issue, acetonitrile, possessing a low HalA, was used as the nucleophile in the catalytic asymmetric Ritter-type chloroamidation of allyl-amides. This method is compatible with Z and E alkenes with both alkyl and aromatic substitution. Mild acidic workup reveals the 1,2-chloroamide products with enantiomeric excess greater than 95% for many examples. We also report the successful use of the sulfonamide chlorenium reagent dichloramine-T in this chlorenium-initiated catalytic asymmetric Ritter-type reaction. Facile modifications lead to chiral imidazoline, guanidine, and orthogonally protected 1,2,3 chiral tri-amines.

Intermolecular haloamination reactions are challenging due to the high halenium affinity of the nitrogen atom. This is circumvented by using acetonitrile as an attenuated nucleophile, resulting in an enantioselective halo-Ritter reaction.     

Prediction of sound velocity and compressibility via molecular simulation at fixed entropy

A molecular-level simulation route is proposed to compute the isentropic thermodynamic properties in a fluid system by Monte Carlo simulation at fixed entropy. The method involves computation of the pressure response of a system to an infinitesimal change in system density by introduction of a single molecule, while retaining the system volume as well as the absolute molar entropy. The probability for accepting a change in temperature during the Monte Carlo moves was weighted against the argument proposed by Smith et al. [W.R. Smith, M. Lísal, I. Nezbeda, Chem. Phys. Lett. 426 (2006) 436–440]. Application to fluid argon has confirmed superior accuracy for the technique within the gas state to yield results within 1.2% of the measured values for the range of thermodynamic conditions investigated.     

‘Fixed charge’ chemical derivatization and data dependant multistage tandem mass spectrometry for mapping protein surface residue accessibility

Protein surface accessible residues play an important role in protein folding, protein-protein interactions and protein-ligand binding. However, a common problem associated with the use of selective chemical labeling methods for mapping protein solvent accessible residues is that when a complicated peptide mixture resulting from a large protein or protein complex is analyzed, the modified peptides may be difficult to identify and characterize amongst the largely unmodified peptide population (i.e., the ‘needle in a haystack’ problem). To address this challenge, we describe here the development of a strategy involving the synthesis and application of a novel ‘fixed charge’ sulfonium ion containing lysine-specific protein modification reagent, S,S′-dimethylthiobutanoylhydroxysuccinimide ester (DMBNHS), coupled with capillary HPLC-ESI-MS, automated CID-MS/MS, and data-dependant neutral loss mode MS³ in an ion trap mass spectrometer, to map the surface accessible lysine residues in a small model protein, cellular retinoic acid binding protein II (CRABP II). After reaction with different reagent:protein ratios and digestion with Glu-C, modified peptides are selectively identified and the number of modifications within each peptide are determined by CID-MS/MS, via the exclusive neutral loss(es) of dimethylsulfide, independently of the amino acid composition and precursor ion charge state (i.e., proton mobility) of the peptide. The observation of these characteristic neutral losses are then used to automatically ‘trigger’ the acquisition of an MS³ spectrum to allow the peptide sequence and the site(s) of modification to be characterized. Using this approach, the experimentally determined relative solvent accessibilities of the lysine residues were found to show good agreement with the known solution structure of CRABP II.     

Adsorption of triton X-100 on silica gel: effects of temperature and alcohols

Adsorption of Triton X-100 (TX-100) on silica gel has been studied as a function of temperature (308–328 K) and composition for mixtures of water with ethanol or t-butanol. The adsorption capacity of silica gel for TX-100 decreases with increase in alcohol content. Adsorption isotherms of TX-100 on silica gel are four-region and were analyzed using the ARIAN (adsorption isotherm regional analysis) model. Data in regions 2, 3 and 4 were fitted to the Temkin, bilayer and reverse desorption isotherms, respectively. The results show that adsorption of TX-100 on silica gel in water and alcohol-water binary mixtures occurs mainly through formation of monolayer surface aggregates or low bilayer coverage.      

Implementing and using high-order finite element methods

We present theoretical analyses of and detailed timings for two programs which use high-order finite element methods to solve the Navier- Strokes equations in two and three dimensions. The analyses show that algorithms popular in low-order finite element implementations are not always appropriate for high-order methods. The timings show that with the proper algorithms high-order finite element methods are viable for solving the Navier-Stokes equations. We show that it is more efficient, both in time and storage, not to precompute element matrices as the degree of approximating functions increases. We also study the cost of assembling the stiffness matrix versus directly evaluating bilinear forms in two and three dimensions. We show that it is more efficient not to assemble the full stiffness matrix for high-order methods in some cases. We consider the computational issues with regard to both Euclidean and isoparametric elements. We show that isoparametric elements may be used with higher-order elements without increasing the order of computational complexity.     

Highly Stereoselective Intermolecular Haloetherification and Haloesterification of Allyl Amides

An organocatalytic and highly regio‐, diastereo‐, and enantioselective intermolecular haloetherification and haloesterification reaction of allyl amides is reported. A variety of alkene substituents and substitution patterns are compatible with this chemistry. Notably, electronically unbiased alkene substrates exhibit exquisite regio‐ and diastereoselectivity for the title transformation. We also demonstrate that the same catalytic system can be used in both chlorination and bromination reactions of allyl amides with a variety of nucleophiles with little or no modification.     

Cyclopropanation and epoxidation of 2-ylidene derivatives of lupane series

Russian Journal of Organic Chemistry - Crotone condensation of allobetulone with fluorine-containing benzaldehydes afforded new α,β-unsaturated ketones of lupane series. Their...