Functionalization Of 2d-Zno for Selective Gas Sensing: First-Principles Analysis

The scope of this MSc thesis is to theoretically search for suitable materials and relevant factors (e.g., dopants and catalysts) to induce gas sensing (GS) selectivity towards harmful gases such as H2, H2S, and CO2, under ambient conditions. We chose as material 2D-ZnO Honeycomb in the form of nanoribbon (ZnO-NR), which is very promising in the gas sensing applications. We employed a state-of-the-art computational method, based on a combination of the density-functional theory (DFT) and the Non-Equilibrium Green’s Functions (NEGF) formalism, which both are incorporated in Atomistic Toolkit (ATK) package. This package is famous for its reliability in estimating the IV characteristics. The thesis consists of three phases: (1) Effect of dopants on gas sensing: Three organic-atoms (e.g., N, C, F) were initially attempted. But selectivity towards the detection of H2 was achieved only in N-doped ZnO-NR. Special trend, discovered about the secrete of such selectivity, was the existence of negative differential resistance (NDR) in the IV characteristics of ZnONR: N. (2) Origins of NDR: the previous results led us to search for the origins of NDR in N-doped ZnO-NRs. We have investigated the effect of placing the doping atom N in three different positions across ZnO-NR, with respect to the edges (i.e.(i) at the Oric hedge, (ii) at the center, and (iii) at the Zn-rich edge.) Results show a clear trend that NDR shifts to higher energies than Fermi level, as well as both NDR and the Topto-Valley-Current Ratio (TVCR), get reduced, when N-atom is moved from O-rich to Zn-rich edges. We concluded that the unpaired electron on N-atom when it gets charged, causes the localization/curdling of the wave function at Fermi-level and consequently causes backscattering and drawback of current (so named NDR). (3) Effect of catalysts on gas sensing: Five transition-metal atoms (Pt, Pd, Au, Ag, and Fe) were used as ad-atom decorating ZnO-NR aiming to induce selectivity towards gases of interest (H2, H2S, and CO2) in existence of other gases (e.g., O2, N2, and H2O) at room temperature (RT). Results show that both Pt and Pd have poor selectivity at RT. Whereas, Fe is found to yield high selectivity toward detecting CO2, while both Au and Ag have selectivity towards H2S, at RT. All our findings are in excellent agreement with experimental data

Inactive alleles of cytochrome P450 2C19 may be positively selected in human evolution Genome evolution and evolutionary systems biology

© 2014 Janha et al.; licensee BioMed Central Ltd.Background: Cytochrome P450 CYP2C19 metabolizes a wide range of pharmacologically active substances and a relatively small number of naturally occurring environmental toxins. Poor activity alleles of CYP2C19 are very frequent worldwide, particularly in Asia, raising the possibility that reduced metabolism could be advantageous in some circumstances. The evolutionary selective forces acting on this gene have not previously been investigated. We analyzed CYP2C19 genetic markers from 127 Gambians and on 120 chromosomes from Yoruba, Europeans and Asians (Japanese + Han Chinese) in the Hapmap database. Haplotype breakdown was explored using bifurcation plots and relative extended haplotype homozygosity (REHH). Allele frequency differentiation across populations was estimated using the fixation index (FST) and haplotype diversity with coalescent models. Results: Bifurcation plots suggested conservation of alleles conferring slow metabolism (CYP2C19∗2 and ∗3). REHH was high around CYP2C19∗2 in Yoruba (REHH 8.3, at 133.3 kb from the core) and to a lesser extent in Europeans (3.5, at 37.7 kb) and Asians (2.8, at -29.7 kb). FST at the CYP2C19 locus was low overall (0.098). CYP2C19∗3 was an FST outlier in Asians (0.293), CYP2C19 haplotype diversity ST is low at the CYP2C19 locus, suggesting balancing selection overall. The biological factors responsible for these selective pressures are currently unknown. One possible explanation is that early humans were exposed to a ubiquitous novel toxin activated by CYP2C19. The genetic adaptation took place within the last 10,000 years which coincides with the development of systematic agricultural practices.This work was supported by the Medical Research Council Unit The Gambia and the European and Developing Countries Clinical Trials Partnership [grant number CG_ta_05_40204_018]

Schizophrenia pathophysiology: are we any closer to a complete model?

Schizophrenia, a severe brain disorder that involves hallucinations, disordered thinking and deficiencies in cognition, has been studied for decades in order to determine the early events that lead to this neurological disorder. In this review, we interpret the developmental and genetic models that have been proposed and treatment options associated with these models

Carbon Nanoparticles-Decorated Carbon Nanotubes

© 2020, The Author(s). Multi walled carbon nanotubes (MWCNTs) were decorated by activated carbon nanoparticles of resorcinol-formaldehyde aerogels. Carbon nanospheres and MWCNTs were mixed by equal mass ratios for different durations. The products were characterized by Raman spectroscopy, thermal gravimetric analysis, nanoscanning electron microscopy, transmission electron microscopy and x-ray diffraction. The results indicated that a significant decoration with carbon nanoparticles occurred onto the MWCNTs.This publication was made possible by the NPRP award (NPRP 08-014-2-003) from the Qatar National Research Fund (a member of The Qatar Foundation). The statements made herein are solely the responsibility of the authors. Technical support from the Department of Chemical Engineering, the Central Laboratories Unit (CLU) and Gas Processing Centre (GPC) at Qatar University is also acknowledged. The publication of this article was funded by the Qatar National Library

Influence of Culture and Management Systems on PMS

Purpose: The aim of this study is to find and explore the relationships between organizational culture, management Systems and the implementation and Operationalisation aspects of Performance Measurement Systems (PMS). Design/methodology/approach: The relevant literature on organizational culture, Organizational behavior, Strategic management and management accounting, in the context of performance measurement systems, will be examined. A structured questionnaire will be used to survey the views of the top management teams of a suitable sample of organizations. The survey implementation process will follow four steps: pre-­‐notification, initial mailing, first follow up and, second follow up. Findings: As this is a developmental paper, it is not possible to provide definite findings at this point. However, it is anticipated to find out relationship between Culture, Management systems and PMS. Practical implications: The findings of this study will provide managers with better understanding of the relationship between organizational culture, management systems and PMS. This will in turn help them to provide a successful PMS. Originality/value: No research has been done to find out the relationship between organizational culture, management systems and two aspects of PMS, namely implementation and operationalisation aspects, using a large-­‐scale sample approach. The findings of this research therefore will provide useful insights and methods for future researchers in this area

ARCOQ: Arabic Closest Opposite Questions Dataset

This paper presents a dataset for closest opposite questions in Arabic language. The dataset is the first of its kind for the Arabic language. It is beneficial for the assessment of systems on the aspect of antonymy detection. The structure is similar to that of the Graduate Record Examination (GRE) closest opposite questions dataset for the English language. The introduced dataset consists of 500 questions, each contains a query word for which the closest opposite needs to be determined from among a set of candidate words. Each question is also associated with the correct answer. We publish the dataset publicly in addition to providing standard splits of the dataset into development and test sets. Moreover, the paper provides a benchmark for the performance of different Arabic word embedding models on the introduced dataset

Biomechanical comparison of standing posture and during trot between German shepherd and Labrador retriever dogs.

Funder: The Kennel Club Charitable Trust; Grant(s): Project ID: 4093 Project Code: 9653It is widely accepted that canine breeds stand and move differently. The prevalence of various musculoskeletal disorders such as hip and elbow dysplasia is also different between breeds. German shepherd dog (GSD) and Labrador retriever dog (LRD) are two large breeds with different conformations that have high prevalence of these disorders. This study quantifies the movement and standing posture of twelve healthy GSDs and twelve healthy LRDs to identify biomechanical similarities and differences that may be linked to sub-optimal hip and elbow mechanics. A pressure walkway and a motion capture system obtained measures of kinetics, kinematics and conformation during standing and trot. During standing, LRDs carry a greater percentage of the weight on the forelimbs (69%±5% vs. GSDs: 62%±2%, p<0.001) and their body Centre of Pressure (CoP) is located more cranially (p<0.001). GSDs had a greater pelvic tilt (79°±8 vs. 66°±9°, p = 0.004), more flexed stifles (44°±9° vs. LRDs: 34°±10°, p<0.05) and hocks (58°±11° vs. 26°±9°, p<0.01) and more extended hips (-10°±11° vs. 30°±12°, p<0.001). During trot, the GSDs' CoP had a longer anterior-posterior trajectory (151%±22% vs. LRDs: 93%±25% of the withers height, p<0.001). Stride parameters and loading of limbs were similar when normalised to the size and weight of the dog, respectively. The LRDs had a more extended thoracolumbar angle (p<0.001) and a less flexed lumbosacral angle (p<0.05). The LRDs' hip remained flexed during trot whereas the GSDs' hip joint was less flexed during swing (p<0.001) and more extended in late stance and early swing (p<0.001). In conclusion, the LRDs and GSDs differ in the way they stand and move and this would result in different loading pattern of the joints. Further investigation is required to determine the extent to which biomechanical differences are linked to musculoskeletal problems presented clinically

Different conformations of the German shepherd dog breed affect its posture and movement

Funder: The Kennel Club Charitable TrustAbstract: The conformation of the German shepherd dog (GSD) varies considerably within the breed. These differences may result in large variation in the movement and limb loading and undesirable consequences to their musculoskeletal health. This study aimed to investigate the relationship between conformation and biomechanical measures in 60 GSDs. Full body kinematic and kinetic measures were computed from 3D motion capture and pressure data. The dogs were divided into groups based on their back slope and curvature. Correlation analysis and statistical differences between groups showed that GSDs with a greater back slope have a greater contact area in their forelimbs and place them closer together when standing (n = 60). During trot, the dogs with sloped back showed a greater vertical force in the forelimbs and a greater mid-thoracic flexion (n = 60). Unilateral differences were found in the stifle flexion, hock flexion and hock adduction, suggesting greater movement asymmetry with an increase in the back slope (n = 30). In conclusion, several biomechanical parameters are affected by the GSD’s slope of the back and not by its curvature. Further studies are required to determine whether the variation in movement, posture and conformation within the breed relates to an increased susceptibility to musculoskeletal disorders

The fodder grass resources for ruminants: A indigenous treasure of local communities of Thal desert Punjab, Pakistan

Indigenous people have been using local grasses for rearing their animals for centuries. The present study is the first record of traditional knowledge of grasses and livestock feeding system from the Thal desert in Pakistan. A snowball sampling method was used to identify key participants. Information was collected from the respondents from six districts of Thal Desert through semi-structural questionnaire and site visits. The data was analyzed through Smith's salience index and Composite Salience using ANTHROPAC package in R software. On the whole 61 grasses were recorded from the study area: most of them belong to the Poaceae family (52 species). Based on palatability grasses were categorized into three major groups i.e. (A) High priority, (B) Medium priority and (C) Low priority. Species in Group A, abundantly present in the study area represent a source of highly palatable forage for all ruminants. 232 (141M +91W) local participants were interviewed. Participants were grouped into three major age categories: 20-35 (48 participants), 36-50 (116 participants) and 51-67 years old (68 participants). ANTHROPAC frequency analysis confirmed the Smith's salience index and Composite Salience; Cynodon dactylon was the favorite species (6.46 SI, 0.6460 CS) followed by Cymbopogon jwarancusa (5.133 SI, 0.5133 CS) and Sorghum sp. was the third most salient species (5.121 SI, 0.5121 CS). Grasses were mostly available during the months of August and October and had also ethnoveterinary importance. This document about the traditional feeding of livestock in Thal Desert can underline the importance of conserving a traditional knowledge, which was poorly documented before

Comparative analysis of the efficacy of astigmatic correction after wavefront-guided and wavefront-optimized LASIK in low and moderate myopic eyes

AIM: To evaluate and compare the efficacy of the astigmatic correction achieved with laser in situ keratomileusis (LASIK) in eyes with myopic astigmatism using wavefront-guided (WFG) and wavefront-optimized (WFO) ablation profiles. METHODS: Prospective study included 221 eyes undergoing LASIK: 99 and 122 eyes with low and moderate myopic astigmatism (low and moderate myopia groups). Two subgroups were differentiated in each group according to the ablation profile: WFG subgroup, 109 eyes (45/64, low/moderate myopia groups) treated using the Advanced CustomVue platform (Abbott Medical Optics Inc.), and WFO subgroup, 112 eyes (54/58, low/moderate myopia groups) treated using the EX-500 platform (Alcon). Clinical outcomes were evaluated during a 6-month follow-up, including a vector analysis of astigmatic changes. RESULTS: Significantly better postoperative uncorrected visual acuity and efficacy index was found in the WFG subgroups of each group (P≤0.041). Postoperative spherical equivalent and cylinder were significantly higher in WFO subgroups (P≤0.003). In moderate myopia group, a higher percentage of eyes with a postoperative cylinder ≤0.25 D was found in the WFG subgroup (90.6% vs 65.5%, P=0.002). In low and moderate myopia groups, the difference vector was significantly higher in the WFO subgroup compared to WFG (P<0.001). In moderate myopia group, the magnitude (P=0.008) and angle of error (P<0.001) were also significantly higher in the WFO subgroup. Significantly less induction of high order aberrations were found with WFG treatments in both low and moderate myopia groups (P≤0.006). CONCLUSION: A more efficacious correction of myopic astigmatism providing a better visual outcome is achieved with WFG LASIK compared to WFO LASIK.Partially supported by a grant from Abbott Medical Optics