Deliberately Losing Control of C−H Activation Processes in the Design of Small-Molecule-Fragment Arrays Targeting Peroxisomal Metabolism

Combined photochemical arylation, “nuisance effect” (S_NAr) reaction sequences have been employed in the design of small arrays for immediate deployment in medium-throughput X-ray protein–ligand structure determination. Reactions were deliberately allowed to run “out of control” in terms of selectivity; for example the ortho-arylation of 2-phenylpyridine gave five products resulting from mono- and bisarylations combined with S_NAr processes. As a result, a number of crystallographic hits against NUDT7, a key peroxisomal CoA ester hydrolase, have been identified.     

Investigation on sulphonated zinc oxide nanorod incorporated sulphonated poly (1,4-phenylene ether ether sulfone) nanocomposite membranes for improved performance of microbial fuel cell

Hydrothermally prepared zinc oxide nanorods are sulphonated (S–ZnO NR) and incorporated into 15% Sulphonated Poly (1,4-Phenylene Ether Ether Sulfone) (SPEES) to improve the hydrophilicity, water uptake and ion transfer capacity. Water uptake and ion transfer capacity increased to 34.6 ± 0.6% and 2.0 ± 0.05 meq g^?1 from 29.8 ± 0.3% and 1.4 ± 0.04 meq g^?1 by adding 7.5 wt% S–ZnO NR to SPEES. Morphological studies show the prepared S–ZnO NR is well dispersed in the polymer matrix. SPEES +7.5 wt% S–ZnO NR membrane exhibits optimum performance after three-weeks of continual operation in a fabricated microbial fuel cell (MFC) to produce a maximum power density of 142 ± 1.2 mW m^?2 with a reduced biofilm compared to plain SPEES (59 ± 0.8 mW m^?2), unsulphonated filler incorporated SPEES (SPEES + 7.5 wt% ZnO, 68 ± 1.1 mW m^?2) and Nafion (130 ± 1.5 mW m^?2) thereby suggesting its suitability as a sustainable and improved cation exchange membrane (CEM) for MFCs.     

Impact of power-supply noise on timing in high-frequency microprocessors

This paper analyzes the impact of power-supply noise on the performance of high-frequency microprocessors. First, delay models that take this noise into account are proposed for device-dominated and interconnect-dominated timing paths. For typical circuits, it is shown that the peak of the noise is largely irrelevant and that the average supply voltage during switching is more important. It is then argued that global differential noise can potentially have a greater timing impact than common-mode noise. Finally, realistic values for the model parameters are measured on a 2.53-GHz Pentium4 microprocessor using a 130-nm technology. These values imply that the power-supply noise present on the system board reduces clock frequency by 6.7%. The model suggests that the frequency penalty associated with this power-supply noise will steadily increase and reach 7.6% for the 90-nm technology generation.     

Multi-grid domain decomposition approach for solution of Navier–Stokes equations in primitive variable form

A new multi-grid (two-grid) pseudospectral element method has been carried out for solution of incompressible flow in terms of primitive variable formulation. The main objective of the proposed method is to apply the multi-grid technique solving the incompressible flow problems associated with three commonly encountered multi-grid environments. In domain decomposition terminology, it includes (I) partially overlapped subdomains, each of which has same types of grids; (II) partially overlapped subdomains, each of which has different types of grids; (III) local adaptive subdomains fully overlapped with the original computational domain (composite grids). The approach for flow problems, complex geometry or not, is to first divide the computational domain into a number of subdomains with the inter-overlapping area (partially or fully overlapped). In categories I and II, the fine-grid or coarse-grid subdomains can be defined by their representation, while in category III the fine-grid or coarse-grid subdomains are defined as usual. Next, implement the Schwarz Alternating Procedure (SAP) to exchange the data among subdomains, where the coarse-grid correction is used to remove the high frequency error that occurs when the data interpolation from the fine-grid subdomain to the coarse-grid subdomain is conducted. The strategy behind the coarse-grid correction is to adopt the operator of the divergence of velocity field, which intrinsically links the pressure equation, into this process. The solution of each subdomain can be efficiently solved by the direct (or iterative) eigenfunction expansion technique or preconditioned method with the least storage requirement, i.e. O(N²) in 2-D. Numerical results of (i) driven cavity flow (Re = 100,400) with Cartesian grids (category I) in each subdomain, (ii) driven cavity flow (Re = 3200) with local adaptive grids (category III) in each subdomain, and (iii) flow over a cylinder (Re = 250) with ‘O’ grids in one subdomain and Cartesian grids in another (category II) will be presented in the paper to account for the versatility of the proposed multi-grid method.     

A general enthalpy method for modeling solidification processes

In the present work, a general implicit source-based enthalpy method is presented for the analysis of solidification systems. The proposed approach is both robust and efficient. The performance of the method is illustrated by application to a number of problems taken from recent metallurgical literature.     

Sliding wear behavior of salt bath nitrocarburized medium carbon steel

Salt bath nitrocarburizing is a well-known thermochemical diffusion process for enhancing the tribological and corrosion properties of ferrous components. The current work describes the role of a compound layer developed during nitrocarburizing, both in the ferritic and austenitic regimes of Fe-N-C system, on the sliding wear behavior of a medium carbon steel. The wear behavior of the nitrocarburized steel discs was assessed by the pin-on-disc tests (ASTM G 99-99) under different normal loads running against a hardened SAE52100 pin. It was observed that the compound layer on the surface not only controlled the wear rate but also resisted the adhesive wear/transfer of material from pin to disc, aside from providing low-friction coefficients.     

Analysis of Caching and Replication Strategies for Web Applications

Developers often use replication and caching mechanisms to enhance Web application performance. The authors present a qualitative and quantitative analysis of state-of-the art replication and caching techniques used to host Web applications. Their analysis shows that selecting the best mechanism depends heavily on data workload and requires a careful review of the application's characteristics. They also propose a technique for Web practitioners to compare different mechanisms' performance on their own     

Tensor Clustering for Rendering Many‐Light Animations

Rendering animations of scenes with deformable objects, camera motion, and complex illumination, including indirect lighting and arbitrary shading, is a long‐standing challenge. Prior work has shown that complex lighting can be accurately approximated by a large collection of point lights. In this formulation, rendering of animation sequences becomes the problem of efficiently shading many surface samples from many lights across several frames. This paper presents a tensor formulation of the animated many‐light problem, where each element of the tensor expresses the contribution of one light to one pixel in one frame. We sparsely sample rows and columns of the tensor, and introduce a clustering algorithm to select a small number of representative lights to efficiently approximate the animation. Our algorithm achieves efficiency by reusing representatives across frames, while minimizing temporal flicker. We demonstrate our algorithm in a variety of scenes that include deformable objects, complex illumination and arbitrary shading and show that a surprisingly small number of representative lights is sufficient for high quality rendering. We believe out algorithm will find practical use in applications that require fast previews of complex animation.     

Evaluation of Localized Semantics: Data, Methodology, and Experiments

We present a new data set of 1014 images with manual segmentations and semantic labels for each segment, together with a methodology for using this kind of data for recognition evaluation. The images and segmentations are from the UCB segmentation benchmark database (Martin et al., in International conference on computer vision, vol. II, pp. 416–421, 2001). The database is extended by manually labeling each segment with its most specific semantic concept in WordNet (Miller et al., in Int. J. Lexicogr. 3(4):235–244, 1990). The evaluation methodology establishes protocols for mapping algorithm specific localization (e.g., segmentations) to our data, handling synonyms, scoring matches at different levels of specificity, dealing with vocabularies with sense ambiguity (the usual case), and handling ground truth regions with multiple labels. Given these protocols, we develop two evaluation approaches. The first measures the range of semantics that an algorithm can recognize, and the second measures the frequency that an algorithm recognizes semantics correctly. The data, the image labeling tool, and programs implementing our evaluation strategy are all available on-line (kobus.ca//research/data/IJCV_2007). We apply this infrastructure to evaluate four algorithms which learn to label image regions from weakly labeled data. The algorithms tested include two variants of multiple instance learning (MIL), and two generative multi-modal mixture models. These experiments are on a significantly larger scale than previously reported, especially in the case of MIL methods. More specifically, we used training data sets up to 37,000 images and training vocabularies of up to 650 words. We found that one of the mixture models performed best on image annotation and the frequency correct measure, and that variants of MIL gave the best semantic range performance. We were able to substantively improve the performance of MIL methods on the other tasks (image annotation and frequency correct region labeling) by providing an appropriate prior.