Synthesis,Biochemistry, and Computational Studies of Brominated Thienyl Chalcones: A New Class of Reversible MAO‐B Inhibitors

A series of (2E)‐1‐(5‐bromothiophen‐2‐yl)‐3‐(para‐substituted phenyl)prop‐2‐en‐1‐ones ( TB1 – TB11 ) was synthesized and tested for inhibitory activity toward human monoamine oxidase (hMAO). All compounds were found to be competitive, selective, and reversible toward hMAO‐B except (2E)‐1‐(5‐bromothiophen‐2‐yl)‐3‐(4‐nitrophenyl)prop‐2‐en‐1‐one ( TB7 ) and (2E)‐1‐(5‐bromothiophen‐2‐yl)‐3‐(4‐chlorophenyl)prop‐2‐en‐1‐one ( TB8 ), which were selective inhibitors of hMAO‐A. The most potent compound, (2E)‐1‐(5‐bromothiophen‐2‐yl)‐3‐[4‐(dimethylamino)phenyl]prop‐2‐en‐1‐one ( TB5 ), showed the best inhibitory activity and higher selectivity toward hMAO‐B, with K_i and SI values of 0.11±0.01 μm and 13.18, respectively. PAMPA assays for all compounds were carried out in order to evaluate the capacity of the compounds to cross the blood–brain barrier. Moreover, the most potent MAO‐B inhibitor, TB5 , was found to be nontoxic at 5 and 25 μm , with 95.75 and 84.59 % viability among cells, respectively. Molecular docking simulations were carried out to understand the crucial interactions responsible for selectivity and potency.     

Assessment of waste plastic oil blends on performance,combustion and emission parameters in direct injection compression ignition engine

The present experimental investigation deals with the transformation of waste plastic into oil in a pyrolysis reactor. A single feed at a rate of 8?kg yielded 675?ml of pyrolytic oil. The physiochemical properties of plastic oil (PO) were found to be within American Society for Testing and Material standards with higher kinematic viscosity and carbon residue. The GC-MS and Fourier Transform Infrared Analysis studies revealed the presence of 14 different compounds in PO. Straight diesel–PO blending was carried out at 15% and 30% in volume ratio. At full-load condition, in-cylinder pressure, rate of pressure rise, rate of heat release and peak pressure were higher for PO30% than straight diesel. The brake thermal efficiency for PO blends was found to be slightly higher than straight diesel with a significant increase in brake-specific fuel consumption. Unburned hydrocarbon (UBHC), CO NO _x and smoke emission showed significant variation with PO blends. The physiochemical properties of PO blends significantly affect the engine performance.     

Oviposition Preference and Performance of a Specialist Herbivore Is Modulated by Natural Enemies,Larval Odors,and Immune Status

Journal of Chemical Ecology - Insect herbivores frequently must balance host plant quality and the risk of attack by their natural enemies when making oviposition decisions. Yet, which factor is...     

Long‐term impact of nitrogen and potassium fertilizers on yield,soil nutrients and biochemical parameters of tea

A field experiment was conducted with tea cultivar UPASI‐9 over a period of 9 years to evaluate the long‐term effects of nitrogen (N) and potassium (K) fertilizers on yield, biochemical parameters, soil and leaf nutrient status. The yield increase was as high as 66% over the control for N application of 450 kg ha^?1 year^?1. Polyphenol and amino acid contents increased with increase in K application rate. Positive and significant correlation was found between nitrate reductase activity and the amino acid content of the tea shoots. While ammoniacal nitrogen in the soil was not affected by the application of fertilizer, ammonium acetate extractable K increased. The failure to apply fertilizer resulted in depletion of the organic matter status of the soil. Although increased rate of nitrogen application increased the overall yield of made tea (kg ha^?1 year^?1), the specific yield (kg kg^?1 N) declined. The soil tended to become acidic from frequent application of high doses of nitrogenous fertilizer. The leaf NK status was significantly influenced by the various treatments. Copyright © 2004 Society of Chemical Industry     

Volt–time characteristics of small airgaps with Hyperbolic model

An experimental investigation of the volt–time characteristics of small airgaps is performed. A Hyperbolic model is proposed to account for the results. The constants of the model have a direct bearing on parameters of the Disruptive Effect model for breakdown with non-standard Lightning Impulses (LIs). Analyses with uniform and non-uniform electrodes show their effect on the Hyperbolic model parameters.     

Effect of microstructure on micromechanical performance of dry cortical bone tissues

The mechanical properties of bone depend on composition and structure. Previous studies have focused on macroscopic fracture behavior of bone. In the present study, we performed microindentation studies to understand the deformation properties and microcrack–microstructure interactions of dry cortical bone. Dry cortical bone tissues from lamb femurs were tested using Vickers indentation with loads of 0.245–9.8 N. We examined the effect of bone microstructure on deformation and crack propagation using scanning electron microscopy (SEM). The results showed the significant effect of cortical bone microstructure on indentation deformation and microcrack propagation. The indentation deformation of the dry cortical bone was basically plastic at any applied load with a pronounced viscoelastic recovery, in particular at lower loads. More microcracks up to a length of approximately 20 μm occurred when the applied load was increased. At loads of 4.9 N and higher, most microcracks were found to develop from the boundaries of haversian canals, osteocyte lacunae and canaliculi. Some microcracks propagated from the parallel direction of the longitudinal interstitial lamellae. At loads 0.45 N and lower, no visible microcracks were observed.     

Object-oriented methodology for intersection simulation model under heterogeneous traffic conditions

In developing countries like India, the traffic on roads is highly heterogeneous in nature, with vehicles of widely varying static and dynamic characteristics. In this type of traffic, vehicles do not follow lane discipline and they move freely over the entire width of roadway based on availability of space. To study this type of complex traffic flow and associated vehicular interactions, simulation is considered as an effective tool. An object-oriented methodology (OOM) for heterogeneous traffic simulation is proposed in this paper with focus on mid-block and intersection flow modeling. The paper presents the basics and advanced features of object-oriented programming (OOP) in detail in the context of traffic flow. The sample C++ code is discussed in detail to demonstrate the implementation of OOP features, such as encapsulation, inheritance and polymorphism. The contribution of this research work is the development of software objects for various components such as vehicle, traffic, link and node. This software can be adopted for heterogeneous traffic simulation programs, in general.     

DC Link Filter Design Considerations in Three-Phase Voltage Source Inverter-Fed Induction Motor Drive System

The dc link filter elements in a three-phase voltage source inverter-fed induction motor system can affect the performance of the drive system if not properly chosen. The requirements, design considerations, and a simplified procedure for the selection of filter component values based on minimization of voltage and current ripple currents in the dc link, damping effects, and on resonant frequency considerations are formulated. Typical computational results and experimental waveforms are presented.     

Integrated decision support system for waste minimization analysis in chemical processes

The need to build and operate environmentally friendly plants has challenged the chemical industry to consider waste minimization or even elimination starting from the early stages of process development. A thorough waste minimization analysis requires specialized expertise and is laborious, time-consuming, expensive, and knowledge-intensive. This has caused a major technical barrier for implementing waste minimization programswithin the industry. Previously, we had reported a systematic methodology and a knowledge-based system, called ENVOPExpert, for identifying waste minimization opportunities in chemical processes. In this paper, we propose an integrated qualitative-quantitative methodology to identify waste minimization alternatives and assess their efficacy in terms of environmental impact and process economics. A qualitative analysis is first conducted to identify the sources of wastes and to propose alternatives for eliminating or minimizing them. Environmental impact of each alternative is then calculated by doing a quantitative pollutant balance. The capital expenditure required for implementing the alternative and the resulting plant operating costs are also calculated and used in the evaluation of the waste minimization alternatives. Through this, practical and cost-effective options can be identified. This methodology has been implemented as an integrated decision support system and tested using the hydrodealkylation process case study with satisfactory results.