Activity

7-fold according to field gamma-spectrometry data which corresponded to the radionuclide contamination density of the top 20-cm layer of the soil containing 96-99% of the total radionuclide amount (correlation between the parameters equaled to r0.01 = 0.782, n = 20). A specifically regular structure obviously formed under the set of radionuclide water migration processes seems to be inherent in all systems of the studied type. The results obtained are believed to be of both theoretical and practical importance, since they can contribute to making decisions on the precise monitoring of zones of technogenic accumulation, as well as solving fundamental problems of soil formation and its restoration after technogenic pollution.Melatonin, being an endogenous signaling molecule plays important role in plant growth and stress alleviation. The present study was conducted to evaluate the ameliorative role of melatonin against Cr toxicity in maize seedlings. The Cr toxicity (50, 100 and 200 µM) severely affected hydroponically grown seedlings growth in a dose-dependent manner; however, the melatonin (0.5 and 1.0 µM) application markedly restored toxicity-induced growth retardation. Higher dose of melatonin (1.0 µM) was more effective in case of lower Cr toxicity (50 and 100 µM). Exposure of 200 µM Cr caused 45% and 43% reduction in shoot and root lengths and more than 80% reduction in biomass. In case of 200 µM Cr toxicity, application of 1.0 µM MT effectively restored shoot and root lengths reduction (from 45 to 30%) and biomass decline (from 80 to around 60%). Biomass restoration by 1.0 µM melatonin under 50 and 100 µM Cr was even more pronounced bringing it near to control plants having no Cr exposure. Further, both melatonin levels an of antioxidative enzymatic system.An implementation of the three-component one-pot approach to unsymmetrical 1,3,5-trisubstituted-1,2,4-triazoles into combinatorial chemistry is described. The procedure is based on the coupling of amidines with carboxylic acids and subsequent cyclization with hydrazines. After the preliminary assessment of the reagent scope, the method had 81% success rate in parallel synthesis. It was shown that over a billion-sized chemical space of readily accessible (“REAL”) compounds may be generated based on the proposed methodology. Analysis of physicochemical parameters shows that the library contains significant fractions of both drug-like and “beyond-rule-of-five” members. More than 10 million of accessible compounds meet the strictest lead-likeness criteria. Additionally, 195 Mln of sp3-enriched compounds can be produced. This makes the proposed approach a valuable tool in medicinal chemistry.The line notations of chemical structures are more compact than those of graphs and connection tables, so they can be useful for storing and transferring a large number of molecular structures. The simplified molecular input line system (SMILES) representation is the most extensively used, as it is much easier to utilise and comprehend than others, and it can be generated automatically from connection tables. A SMILES represents and encodes the molecule structure. It has been used by an existing method, LINGO, to calculate the molecular similarities and predict the structure-related properties. The LINGO method decomposes a canonical SMILES into a set of substrings of four characters referred to as LINGOs. The purpose of LINGO method is to measure the similarity between a pair of molecules by comparing the LINGOs that occur in each molecule. This paper aims to introduce an alternative version of the LINGO method using LINGOs of different lengths, called LINGO-DL. selleck compound LINGO-DL is based on the fragmentation of canonical SMILES into substrings of three different lengths rather than one in LINGO method. Retrospective virtual screening experiments with MDDR, DUD, and MUV datasets show that the LINGO-DL outperforms the LINGO method, especially when the active molecules being sought have a high degree of structural heterogeneity.Identifying patients at increased risk for HIV acquisition can be challenging. Primary care providers (PCPs) may benefit from tools that help them identify appropriate candidates for HIV pre-exposure prophylaxis (PrEP). We and others have previously developed and validated HIV risk prediction models to identify PrEP candidates using electronic health records data. In the current study, we convened focus groups with PCPs to elicit their perspectives on using prediction models to identify PrEP candidates in clinical practice. PCPs were receptive to using prediction models to identify PrEP candidates. PCPs believed that models could facilitate patient-provider communication about HIV risk, destigmatize and standardize HIV risk assessments, help patients accurately perceive their risk, and identify PrEP candidates who might otherwise be missed. However, PCPs had concerns about patients’ reactions to having their medical records searched, harms from potential breaches in confidentiality, and the accuracy of model predictions. Interest in clinical decision-support for PrEP was greatest among PrEP-inexperienced providers. Successful implementation of prediction models will require tailoring them to providers’ preferences and addressing concerns about their use.We assessed the effect of depression, hopelessness, and self-concept on HIV prevention attitudes and knowledge about infection, transmission and sexual risk behavior among adolescents living with HIV in Uganda. Utilizing longitudinal data from 635 adolescents living with HIV, multiple ordinary least square regression was used to evaluate associations between the three indicators of mental health functioning at baseline and HIV knowledge and prevention attitudes at 12-months follow-up. We found that depression (β = - 0.17; 95% CI – 0.31, – 0.04) and hopelessness (β = - 0.16; 95% CI – 0.28, – 0.04) scores at baseline were associated with a 0.17 and 0.16 average reduction in HIV prevention attitudes and HIV knowledge scores, respectively at 12-months follow-up. However, self-concept was not significantly associated with HIV knowledge or prevention attitudes. Adolescents living with HIV with greater levels of hopelessness are at increased risk of having limited HIV knowledge while those with greater symptoms of depression had less favorable HIV prevention attitudes.