Search Results - "Rao, Priyashi"
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Revealing the molecular interplay of curcumin as Culex pipiens Acetylcholine esterase 1 (AChE1) inhibitor
Published in Scientific reports (01-09-2021)“…Emergence of vector borne diseases has continued to take toll on millions of lives since its inception. The use of insecticides began as vector control…”
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Extending the lore of curcumin as dipteran Butyrylcholine esterase (BChE) inhibitor: A holistic molecular interplay assessment
Published in PloS one (26-05-2022)“…Since its origin, the emergence of vector-borne infections has taken a toll on incalculable human lives. The use of chemical insecticides is one of the early…”
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Molecular insights on ar-turmerone as a structural, functional and pharmacophoric analogue of synthetic mosquito repellent DEET by comprehensive computational assessment
Published in Scientific reports (16-09-2022)“…Mosquitoes are vectors for a variety of infectious illnesses, and chemical synthetic insecticides have made it possible to control them effectively. Mosquito…”
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Twin Peaks: Presenting the Antagonistic Molecular Interplay of Curcumin with LasR and LuxR Quorum Sensing Pathways
Published in Current microbiology (01-08-2020)“…Quorum sensing in bacteria is a cell density-dependent phenomenon in which, a community of cells communicate with each other using signalling molecules…”
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Identifying structural–functional analogue of GRL0617, the only well-established inhibitor for papain-like protease (PLpro) of SARS-CoV2 from the pool of fungal metabolites using docking and molecular dynamics simulation
Published in Molecular diversity (01-02-2022)“…The non-structural protein (nsp)-3 of SARS-CoV2 coronavirus is sought to be an essential target protein which is also named as papain-like protease (PLpro)…”
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Pinpointing top inhibitors for GSK3β from pool of indirubin derivatives using rigorous computational workflow and their validation using molecular dynamics (MD) simulations
Published in Scientific reports (02-01-2024)“…Glycogen synthase kinase-3β (GSK3β) is a pivotal protein kinase implicated in a spectrum of debilitating diseases, encompassing cancer, diabetes, and…”
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Perceiving SARS-CoV-2 Mpro and PLpro dual inhibitors from pool of recognized antiviral compounds of endophytic microbes: an in silico simulation study
Published in Structural chemistry (01-10-2022)“…Coronavirus disease 2019 (COVID-19) persists and shook the global population where the endgame to this pandemic is brought on by developing vaccines in…”
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Meticulous assessment of natural compounds from NPASS database for identifying analogue of GRL0617, the only known inhibitor for SARS-CoV2 papain-like protease (PLpro) using rigorous computational workflow
Published in Molecular diversity (01-02-2022)“…The latest global outbreak of 2019 respiratory coronavirus disease (COVID-19) is triggered by the inception of novel coronavirus SARS-CoV2. If recent events…”
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Prophylactic Treatment of Probiotic and Metformin Mitigates Ethanol-Induced Intestinal Barrier Injury: In Vitro, In Vivo, and In Silico Approaches
Published in Mediators of inflammation (2021)“…Ethanol depletes intestinal integrity and promotes gut dysbiosis. Studies have suggested the individual role of probiotics and metformin Met in protecting…”
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10
Extending the lore of curcumin as dipteran Butyrylcholine esterase
Published in PloS one (26-05-2022)“…Since its origin, the emergence of vector-borne infections has taken a toll on incalculable human lives. The use of chemical insecticides is one of the early…”
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11
Reckoning a fungal metabolite, Pyranonigrin A as a potential Main protease (Mpro) inhibitor of novel SARS-CoV-2 virus identified using docking and molecular dynamics simulation
Published in Biophysical chemistry (01-09-2020)“…The novel SARS-CoV-2 is the etiological agent causing the Coronavirus disease 2019 (COVID-19), which continues to become an inevitable pandemic outbreak. Over…”
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Identification of hub genes associated with prognosis of lung cancer via integrated bioinformatics and in vitro approach
Published in Journal of biomolecular structure & dynamics (21-12-2023)“…Lung cancer is a severe health problem that affects more men than women around the world. The goal of this study was to identify the biomarker hub genes for…”
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Curcumin interferes with chitin synthesis in Aedes aegypti: a computational and experimental investigation
Published in Molecular diversity (01-06-2024)“…Throughout history, vector-borne diseases have consistently posed significant challenges to human health. Among the strategies for vector control, chemical…”
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Cry toxins of Bacillus thuringiensis: a glimpse into the Pandora’s box for the strategic control of vector borne diseases
Published in Environmental sustainability (01-03-2021)“…Pests are small organisms which are detrimental for humans, crops, livestock and forestry and mainly belong to phylum Arthropoda. Insects serve as pests for…”
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Identifying potential human and medicinal plant microRNAs against SARS-CoV-2 3′UTR region: A computational genomics assessment
Published in Computers in biology and medicine (01-09-2021)“…The coronavirus disease of 2019 (COVID-19) began as an outbreak and has taken a toll on human lives. The current pandemic requires scientific attention; hence…”
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The rise of gingerol as anti-QS molecule: Darkest episode in the LuxR-mediated bioluminescence saga
Published in Bioorganic chemistry (01-06-2020)“…[Display omitted] •First study on LuxR dependant inhibition of Quorum sensing in Vibrio alginolyticus.•Characterizing Gingerol as anti-QS molecule for several…”
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Repurposing the antibacterial drugs for inhibition of SARS-CoV2-PLpro using molecular docking, MD simulation and binding energy calculation
Published in Molecular diversity (01-08-2022)“…Papain-like protease (nsp-3; non-structural protein) of novel corona virus is an ideal target for developing drugs as it plays multiple important functions for…”
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Unravelling the antifungal mode of action of curcumin by potential inhibition of CYP51B: A computational study validated in vitro on mucormycosis agent, Rhizopus oryzae
Published in Archives of biochemistry and biophysics (15-11-2021)“…Like human, fungi too are known to share lot of structural similarities amongst their CYPs (Cytochrome P450 super family of enzymes) which allows antifungal…”
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Rapid method for detection, quantification and measuring microbial degradation of pesticide-thiram using high performance thin layer chromatography (HPTLC)
Published in Environmental science and pollution research international (2023)“…Thiram (tetramethylthiuramdisulfide) or thiram sulphide is a dithiocarbamate group of non-systemic group of fungicide which are applied for seed treatment,…”
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Unveiling the nature's fruit basket to computationally identify Citrus sinensis csi-mir169–3p as a probable plant miRNA against Reference and Omicron SARS-CoV-2 genome
Published in Computers in biology and medicine (01-07-2022)“…The fundamental role of microRNAs (miRNAs) has long been associated with regulation of gene expression during transcription and post transcription of mRNA's…”
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