INSILICO DESIGN, SYNTHESIS AND CHARACTERIZATION OF SOME NOVEL BENZOTHIAZOLE DERIVATIVES AS ANTI-CANCER AGENTS

Objectives: Cancer is a disease characterized by uncontrollable, irreversible, independent, autonomous, uncoordinated and relatively unlimited and abnormal over growth of tissues. Breast cancer is the second most common type of cancer after lung cancer. The aim of the study is to carry out the docking studies, synthesis and anti-tumour activities  of Benzothiazole derivatives containing oxadiazole groups or amino groups.Methods: The docking studies of benzothiazole derivatives were done with known anti-cancer targets like oestrogen receptor by using argus lab and auto dock programmes with the standard drug tamoxifen. Based upon  the results obtained from the molecular modeling, the derivatives were selected for the synthesis. The synthesized compounds were characterized by melting point, TLC, IR, 1H NMR, 13CNMR, MASS spectral data and screened for their in- vitro anti-cancer activities.Results: The docking scores obtained for benzothiazole derivatives (BT1,BT2,BT3,BT4) and std.tamoxifen  from the preliminary docking program by using  argusLab  were- 9.68,-9.4,-9.59, -11.1988,-9.71 and  by using autodock program were -6.29, -5.25,-7.19,-7.48,-3.86 respectively. All the four derivatives were synthesized, characterized and subjected to in vitro anticancer screening by MTT assay in breast cancer (MCF-7) cell lines. Compounds DBT1, DBT2, DBT3 were the most active compounds against MCF-7 cell lines with IC50 of 70.0, 64.0 and 65.0, respectively.Conclusion: All the four  derivatives show  good docking scores when compared to standard drug and can be concluded that all the synthesized benzothiazole  ligands show good anti-cancer property.Keywords: Benzothiazole, Oxadiazole, Estrogen receptor, Anticancer targets

REVIEW ON EVALUATING THE ROLE OF NSAIDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE

Recently, several studies have been reported that nonsteroidal anti-inflammatory drugs can fight against neurodegenerative disorders by various mechanisms. Currently, available therapies of neurodegenerative disorders (NDs) provide only symptomatic relief. This is the point at which we need an alternative that acts on the root cause of disease. Parkinson’s disease and Alzheimer’s disease are the two NDs concentrated here. Since the drug profile is already known, drug repurposing is a promising technique in research, thereby reducing the cost and period effectively. Epidemiological studies on various nonsteroidal anti-inflammatory drugs (NSAIDs) showed good results, but when it came to clinical studies the results are found to be poor. Hence, it can be concluded that NSAIDs provide its neuroprotective activity on its long-term use only, as the brain accessibility of this kind of drug is poor due to its lower lipophilicity

Phenotypic and genetic characterization of Dunaliella (Chlorophyta) from Indian salinas and their diversity

Background: The genus Dunaliella (Class – Chlorophyceae) is widely studied for its tolerance to extreme habitat conditions, physiological aspects and many biotechnological applications, such as a source of carotenoids and many other bioactive compounds. Biochemical and molecular characterization is very much essential to fully explore the properties and possibilities of the new isolates of Dunaliella. In India, hyper saline lakes and salt pans were reported to bloom with Dunaliella spp. However, except for the economically important D. salina, other species are rarely characterized taxonomically from India. Present study was conducted to describe Dunaliella strains from Indian salinas using a combined morphological, physiological and molecular approach with an aim to have a better understanding on the taxonomy and diversity of this genus from India. Results: Comparative phenotypic and genetic studies revealed high level of diversity within the Indian Dunaliella isolates. Species level identification using morphological characteristics clearly delineated two strains of D. salina with considerable β-carotene content (>20 pg/cell). The variation in 18S rRNA gene size, amplified with MA1-MA2 primers, ranged between ~1800 and ~2650 base pairs, and together with the phylogeny based on ITS gene sequence provided a pattern, forming five different groups within Indian Dunaliella isolates. Superficial congruency was observed between ITS and rbcL gene phylogenetic trees with consistent formation of major clades separating Indian isolates into two distinct clusters, one with D. salina and allied strains, and another one with D. viridis and allied strains. Further in both the trees, few isolates showed high level of genetic divergence than reported previously for Dunaliella spp. This indicates the scope of more numbers of clearly defined/unidentified species/subspecies within Indian Dunaliella isolates. Conclusion: Present work illustrates Indian Dunaliella strains phenotypically and genetically, and confirms the presence of not less than five different species (or sub-species) in Indian saline waters, including D. salina and D. viridis. The study emphasizes the need for a combined morphological, physiological and molecular approach in the taxonomic studies of Dunaliella

Halophytes of Chenopodiaceae and Aizoaceae from South-East Coast of India as Potential Sources of Essential Nutrients and Antioxidants

In this study, we assessed the antioxidant efficacy and nutritional value of the halophytic plants in order to find possible sources for future novel antioxidants in nutraceutical and pharmaceutical formulations. The lyophilized samples of the five tropical halophytes (Chenopodiaceae and Aizoaceae), namely, Salicornia brachiata, Arthrocnemum indicum, Suaeda maritima, Suaeda monoica, and Sesuvium portulacastrum from the southeast coast of India were analyzed for total digestible protein, amino acid and fatty acid composition using spectrophotometric, HPLC and GC methods, respectively. The aqueous and ethyl acetate extracts of these samples were studied for its free radical scavenging activity using DPPH. radical scavenging assay and total phenolic content (mg GAE/g) using Folin–Ciocalteu method. Protein content of S. brachiata (4.6 g/100g) and S. maritima (4.0 g/100g) were higher than that of others. A good ratio of essential/ non-essential (E/NE) amino acids in all species (>1.0) indicated them as sources of well balanced and high-quality proteins. High DHA (1.33%) and EPA (1.26%) in S. maritima resulted in having a higher n-3:n-6 ratio (0.24) than in other halophytes (0.09-0.16). The PUFA/ SFA ratio was found to be significantly higher in S. brachiata (1.16) due to high 18:2n-6 (16.9%) and 18:3n-6 (21.9%) (p < 0.05), suggesting its ability to thrive under stress conditions, which was supported by the high phenolic contents (557 mg GAE/g) and antioxidant activity against DPPH radical (IC50 0.90 mg/mL) of its EtOAc extract. The presence of high titer of amino acids, fatty acids, nutritional antioxidants (phenolics) and free radical quenching potential of these underutilized species indicate their potential towards human health applications

Scaling of an atmospheric model to simulate turbulence and cloud microphysics in the Pi Chamber

The Pi Cloud Chamber offers a unique opportunity to study aerosol-cloud microphysics interactions in a steady-state, turbulent environment. In this work, an atmospheric large-eddy simulation (LES) model with spectral bin microphysics is scaled down to simulate these interactions, allowing comparison with experimental results. A simple scalar flux budget model is developed and used to explore the effect of sidewalls on the bulk mixing temperature, water vapor mixing ratio, and supersaturation. The scaled simulation and the simple scalar flux budget model produce comparable bulk mixing scalar values. The LES dynamics results are compared with particle image velocimetry measurements of turbulent kinetic energy, energy dissipation rates, and large-scale oscillation frequencies from the cloud chamber. These simulated results match quantitatively to experimental results. Finally, with the bin microphysics included the LES is able to simulate steady-state cloud conditions and broadening of the cloud droplet size distributions with decreasing droplet number concentration, as observed in the experiments. The results further suggest that collision-coalescence does not contribute significantly to this broadening. This opens a path for further detailed intercomparison of laboratory and simulation results for model validation and exploration of specific physical processes

Optic Tract Shrinkage Limits Visual Restoration After Occipital Stroke

BACKGROUND AND PURPOSE: Damage to the adult primary visual cortex (V1) causes vision loss in the contralateral visual hemifield, initiating a process of trans-synaptic retrograde degeneration. The present study examined functional implications of this process, asking if degeneration impacted the amount of visual recovery attainable from visual restoration training in chronic patients, and if restoration training impacted optic tract (OT) shrinkage. METHODS: Magnetic resonance imaging was used to measure OT volumes bilaterally in 36 patients with unilateral occipital stroke. From OT volumes, we computed laterality indices (LI), estimating the stroke-induced OT shrinkage in each case. A subset of these chronic patients (n=14, 13±6 months poststroke) underwent an average of nearly 1 year of daily visual restoration training, which repeatedly stimulated vision in their blind field. The amount of visual field recovery was quantified using Humphrey perimetry, and post training magnetic resonance imaging was used to assess the impact of training on OT shrinkage. RESULTS: OT LI was correlated with time since stroke: it was close to 0 (no measurable OT shrinkage) in subacute participants (6 months poststroke) exhibited LI >0, but with significant variability. Visual training did not systematically alter LI, but chronic patients with baseline LI≈0 (no OT shrinkage) exhibited greater visual field recovery than those with LI>0. CONCLUSIONS: Unilateral OT shrinkage becomes detectable with magnetic resonance imaging by ≈7 months poststroke, albeit with significant interindividual variability. Although visual restoration training did not alter the amount of degeneration already sustained, OT shrinkage appeared to serve as a biomarker of the potential for training-induced visual recovery in chronic cortically blind patients

Assessment of myofascial pain syndrome among married female healthcare workers: a cross sectional comparative study in a tertiary care centre

Background: Myofascial pain syndrome (MPS) is common among females between ages 20-40 years. Psychosomatic and mechanical reasons are attributed as causative factors. Female health care workers (FHW) in hospitals with rapid patient turn over are vulnerable to develop MPS. Our aim was to ascertain the prevalence of MPS in married FHW working in various departments of the hospital and its association with poor sleep and work stress. Methods: We selected married FHWs in 20-50 years age group and divided them into two groups, medical and paramedical (those involved directly and indirectly with patient care respectively). MPS was diagnosed after detailed personal interview and clinical examination. Sleep duration was divided into less than 5 hours and more than 5hours. Presence of work-related stress and other medical parameters were also recorded. Results: A total of 150 medical and 150 paramedical FHWs were included in the study. Overall prevalence of MPS among FHWs was 42%, of which, medical group was 32% and paramedical was 52%. The paramedical group showed significantly higher prevalence of MPS (p: 0.02). Sleep was less than 5 hours in 29.3% of medical FHW and 13.3% of paramedical. This difference didn’t show any association to MPS (p=0.8). 38% FHW perceived excessive work stress, 40% were paramedical and 36% were medical. This didn’t correlate with prevalence of MPS (p=0.2) among them. Conclusions: Paramedical FHW experienced more MPS than medical and it was more of mechanical type and not due to work stress or sleep deprivation

Constraints perceived by the field extension functionaries of Dairy Development Department, Kerala

The study was conducted in Kerala state in 2021–2022, with the objective of identifying the constraints related to effective role performance as perceived by the Field Extension Functionaries (FEFs) of the Dairy Development Department (DDD). Through non-proportionate stratified random sampling, a sample of 120 FEFs was chosen, of whom 60 were Dairy Extension Officers (DEOs) and 60 were Dairy Farm Instructors (DFIs). The study found that inadequate infrastructure facilities and lack of transport facilities were the major physical constraints perceived by the respondents. Among organisational constraints, inadequate staff strength and heavy administrative work were cited as the major constraints. The most significant technological constraints perceived were inadequate knowledge about dairy innovations among the farmers and lack of technical support for implementing schemes. Inadequate budget allocation for programme execution and lack of monitoring and evaluation of schemes were the major managerial constraints. Under communication constraints, weak research-extension-farmer linkage, and lack of feedback from farmers were perceived as the major ones

Stacking disorder in α\alpha-RuCl3_3 via x-ray three-dimensional difference pair distribution function analysis

The van der Waals layered magnet $\alpha$-RuCl$_3$ offers tantalizing prospects for the realization of Majorana quasiparticles. Efforts to understand this are, however, hampered by inconsistent magnetic and thermal transport properties likely coming from the formation of structural disorder during crystal growth, postgrowth processing, or upon cooling through the first order structural transition. Here, we investigate structural disorder in $\alpha$-RuCl$_3$ using x-ray diffuse scattering and three-dimensional difference pair distribution function (3D-$\Delta$PDF) analysis. We develop a quantitative model that describes disorder in $\alpha$-RuCl$_3$ in terms of rotational twinning and intermixing of the high and low-temperature structural layer stacking. This disorder may be important to consider when investigating the detailed magnetic and electronic properties of this widely studied material.Comment: 6 pages; 3 figures; accepted in Physical Review

Guyon's canal syndrome due to tortuous ulnar artery with DeQuervain stenosing tenosynovitis, ligamentous injuries and dorsal intercalated segmental instability syndrome, a rare presentation: a case report

The Guyon's canal syndrome is a well known clinical entity and may have significant impact on patient's quality of life. We report a case of 43-year-old male who presented with complaints of pain and numbness in right hand and difficulty in writing for past one month. On imaging diagnosis of Guyon's canal syndrome because of tortuous ulnar artery was made with additional findings of DeQuervain's stenosing tenosynovitis and dorsal intercalated segmental instability syndrome with ligamentous injury and subsequently these were confirmed on surgery