Conformational analyses and docking studies of a series of 5-nitrofuran- and 5-nitrothiophen-semicarbazone derivatives in three possible binding sites of trypanothione and glutathione reductases

To explore three possible binding sites of trypanothione and glutathione reductase, namely, the active, the dimer interface and the coenzyme NADPH binding site, a series of eight compounds, nitrofurans and nitrothiophenes derivatives, were docked, using their crystallographic and modeled conformations. Docking results showed that, for both families and both enzymes, compounds are more likely to bind in the interface site, even though there is some probability of binding in the active site. These studies are in agreement with experimental data, which suggest that these class of compounds can act either as uncompetitive or mixed type inhibitors, and also with the finding that there is an alpha-helix which connects the active with the interface site, thus allowing charge transference between them.     

Intrinsic Images by Clustering

Decomposing an input image into its intrinsic shading and reflectance components is a long‐standing ill‐posed problem. We present a novel algorithm that requires no user strokes and works on a single image. Based on simple assumptions about its reflectance and luminance, we first find clusters of similar reflectance in the image, and build a linear system describing the connections and relations between them. Our assumptions are less restrictive than widely‐adopted Retinex‐based approaches, and can be further relaxed in conflicting situations. The resulting system is robust even in the presence of areas where our assumptions do not hold. We show a wide variety of results, including natural images, objects from the MIT dataset and texture images, along with several applications, proving the versatility of our method.     

Brazilian articles in international journals on Limnology

Summary  We assessed the contribution of Brazilian limnologists (freshwater ecologists) in international journals in the period 1970-2004. Brazilian contribution was low and regular in the 1970's, but increased steeply after 1980 with no signs of stabilization until the present. Articles authored by Brazilians tend to be less cited than articles authored by non-Brazilians, although this difference is reduced in co-authored articles with international researchers.  Brazilian articles are not distributed homogenously among the sub-areas of Limnology, but present some biases that can be explained by intellectual legacy. Brazil has invested since the 1970's in establishing postgraduate courses in Brazil and in the last years has turned the focus to a better qualification of these courses. We believe these are the main reasons for the conspicuous development of Brazilian Limnology.     

Narrow-FSK optical packet labeling scheme for optical ethernet networks

In this work, an intensity modulation/frequency-shift keying (IM/FSK) orthogonal modulation scheme is achieved by direct modulation of a distributed feedback laser source using its adiabatic chirp characteristics. Optical frequencies for "1" and "0" bits are separated only 0.7 GHz, obtaining a narrow-FSK modulation and, accordingly, a low residual intensity modulation. Ethernet frames at 1.25 Gb/s (GbE) are transmitted with a label inserted using coded mark inversion codification at a 155-Mb/s rate. Error rates for the Ethernet payload and for the label have been measured for different payload extinction ratios, showing the viability of this scheme for distances up to 25 km.     

Second-Order Stiffness Matrix and Loading Vector of a Beam-Column with Semirigid Connections on an Elastic Foundation

The second-order stiffness matrix and corresponding loading vector of a prismatic beam–column subjected to a constant axial load and supported on a uniformly distributed elastic foundation (Winkler type) along its span with its ends connected to elastic supports are derived in a classical manner. The stiffness coefficients are expressed in terms of the ballast coefficient of the elastic foundation, applied axial load, support conditions, bending, and shear deformations. These individual parameters may be dropped when the appropriate effect is not considered; therefore, the proposed model captures all the different models of beams and beam–columns including those based on the theories of Bernoulli–Euler, Timoshenko, Rayleigh, and bending and shear.The expressions developed for the load vector are also general for any type or combinations of transverse loads including concentrated and partially nonuniform distributed loads. In addition, the transfer equations necessary to determine the transverse deflections, rotations, shear, and bending moments along the member are also developed and presented.     

Separating adaptable persistence attributes through computational reflection

To receive persistence capabilities, applications usually must explicitly access database management systems, such as object-oriented databases or object-relational mapping products. The usual way of building an application is tangling its functional code with explicit structured query language (SQL) or object query language (OQL) persistence statements. This tangling has several drawbacks: deficiencies in source code legibility, maintainability, and portability; lack of persistence functionality reuse; and low adaptability of persistence attributes. Separating crosscutting concerns such as persistence from the main application code can reduce software complexity and facilitate concerns reuse. A prototype persistence system shows how to use computational reflection to completely separate and adapt application persistence attribute at runtime.     

Nanoceria coating imperfections and their effect on the high-temperature oxidation resistance of a 304 stainless steel

The microemulsion method was employed in this work for synthesizing nanocrystalline cerium oxide particles. Average nanoparticle sizes of 3.45 nm were produced by these means. XPS determinations indicated that both Ce³⁺ and Ce⁴⁺ are present in the synthesized nanoceria particles, with an average amount of 22.8 % of Ce³⁺ ions. It was found that the nanocrystalline cerium oxide coatings lead to significant improvements (of 1–2 orders of magnitude) in the high-temperature oxidation resistance of 304 SS. In addition, it was found that by decreasing the nanoparticle mean size from 10 to 3.45 nm, the effect of the coating protection was drastically improved. The experimentally determined parabolic rate constants k _p at 1073 and 1273 K for 304 SS indicated a reduction of up to two orders of magnitude when nanoceria coatings with 3.45 nm in mean size were applied. Also, the scale thickness was reduced from 15 to 5 μm when oxidized at 1073 K for 442 h. Coatings with purchased nanoceria particles (10 nm) were not as effective as the coatings with synthesized nanoceria. Apparently, at increasing nanoceria sizes, the oxidation protection is significantly reduced. In addition, it was found that the method of dipping for coating 304 SS does not provide a uniform coverage with nanoceria particles. Fe-rich ‘islands’ develop during high-temperature oxidation indicating that some regions do not exhibit the protection that nanoceria can provide. In contrast, relatively thick-coating regions on the steel substrate exhibit minimal oxidation, and the resultant scale is fine grained and uniform.     

Effect of Proximity and Dimension of Two Artificial Pitting Holes on the Fatigue Endurance of Aluminum Alloy AISI 6061-T6 Under Rotating Bending Fatigue Tests

This work deals with the study of the two artificial pitting holes effects, caused by their dimensions and proximity, on the fatigue endurance of aluminum alloy AISI 6061-T6 under rotating bending fatigue tests. Stress concentration induced by artificial pitting holes is analyzed and correlated with the experimental fatigue life. It is found that the stress concentration increases exponentially when the two pitting holes approach, and this induces an important reduction in the fatigue life. Concerning the diameter variation of one pitting in regard to the second, no important influence was observed on fatigue life for a given separation between them; this implies that the separation between the two artificial pitting holes and the associated stress concentration is the principal parameter on the fatigue life under these conditions. Finally, results are discussed and conclusions are presented involving the fatigue life, proximity, and dimension of pitting holes, stress concentration factor, and fracture surfaces where the failure origin is identified.     

ADSA Foundation Scholar Award: New frontiers in calf and heifer nutrition—From conception to puberty

Dairy calf nutrition is traditionally one of the most overlooked aspects of dairy management, despite its large effect on the efficiency and profitability of dairy operations. Unfortunately, among all animals on the dairy farm, calves suffer from the highest rates of morbidity and mortality. These challenges have catalyzed calf nutrition research over the past decade to mitigate high incidences of disease and death, and improve animal health, growth, welfare, and industry sustainability. However, major knowledge gaps remain in several crucial stages of development. The purpose of this review is to summarize the key concepts of nutritional physiology and programming from conception to puberty and their subsequent effects on development of the calf, and ultimately, future performance. During fetal development, developmental plasticity is highest. At this time, maternal energy and protein consumption can influence fetal development, likely playing a critical role in calf and heifer development and, importantly, future production. After birth, the calf's first meal of colostrum is crucial for the transfer of immunoglobulin to support calf health and survival. However, colostrum also contains numerous bioactive proteins, lipids, and carbohydrates that may play key roles in calf growth and health. Extending the delivery of these bioactive compounds to the calf through a gradual transition from colostrum to milk (i.e., extended colostrum or transition milk feeding) may confer benefits in the first days and weeks of life to prepare the calf for the preweaning period. Similarly, optimal nutrition during the preweaning period is vital. Preweaning calves are highly susceptible to health challenges, and improved calf growth and health can positively influence future milk production. Throughout the world, the majority of dairy calves rely on milk replacer to supply adequate nutrition. Recent research has started to re-evaluate traditional formulations of milk replacers, which can differ significantly in composition compared with whole milk. Transitioning from a milk-based diet to solid feed is critical in the development of mature ruminants. Delaying weaning age and providing long and gradual step-down protocols have become common to avoid production and health challenges. Yet, determining how to appropriately balance the amount of energy and protein supplied in both liquid and solid feeds based on preweaning milk allowances, and further acknowledging their interactions, shows great promise in improving growth and health during weaning. After weaning and during the onset of puberty, heifers are traditionally offered high-forage diets. However, recent work suggests that an early switch to a high-forage diet will depress intake and development during the time when solid feed efficiency is greatest. It has become increasingly clear that there are great opportunities to advance our knowledge of calf nutrition; yet, a more concentrated and rigorous approach to research that encompasses the long-term consequences of nutritional regimens at each stage of life is required to ensure the sustainability and efficiency of the global dairy industry.