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Atomic transport properties namely the shear viscosity and diffusion coefficients for NixCo1-x, CoxFe1-x and NixFe1-x liquid transition metal alloys are investigated systematically by employing statistical mechanical theory known as the distribution function method. As required we describe the interionic interaction by a local pseudopotential model that can take into account d-band effect adequately and, the pair correlation function is derived from the Percus-Yevick theory for hard spheres where the effective hard sphere diameter is determined by the LWCA thermodynamic perturbation theory. Results for shear viscosity agree well with the available experimental data for the whole range of concentration.  相似文献   
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Plasma Chemistry and Plasma Processing - Plasma agriculture is an emerging field. In this report, we studied the effect of medium pressure (~?10 torr) low-frequency...  相似文献   
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The deeper understanding of metastasis phenomenon and detection of drug targets could be a potential approach to minimize cancer mortality. In this study, attempts were taken to unmask novel therapeutics to prevent metastasis and cancer progression. Initially, we explored the physiochemical, structural and functional insights of three metastasis tumor antigens (MTAs) and evaluated some plant-based bioactive compounds as potent MTA inhibitors. From 50 plant metabolites screened, isoflavone, gingerol, citronellal and asiatic acid showed maximum binding affinity with all three MTA proteins. The ADME analysis detected no undesirable toxicity that could reduce the drug likeness properties of top plant metabolites. Moreover, molecular dynamics studies revealed that the complexes were stable and showed minimum fluctuation at molecular level. We further performed ligand-based virtual screening to identify similar drug molecules using a large collection of 376,342 compounds from DrugBank. The results suggested that several structural analogs (e.g., tramadol, nabumetone, DGLA and hydrocortisone) may act as agonist to block the MTA proteins and inhibit cancer progression at early stage. The study could be useful to develop effective medications against cancer metastasis in future. Due to encouraging results, we highly recommend further in vitro and in vivo trials for the experimental validation of the findings.

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Plasma Chemistry and Plasma Processing - Chemical fertilization in agriculture is threatening to the ecosystem. Therefore, the use of eco-friendly stimulant for crop revolution is highly desirable....  相似文献   
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