Search Results - "Jha, Anupam Nath"
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Leishmaniasis: Omics Approaches to Understand its Biology from Molecule to Cell Level
Published in Current protein & peptide science (01-01-2023)“…Leishmaniasis is the second deadliest vector-borne, neglected tropical zoonotic disease and is found in a variety of clinical forms based on genetic…”
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Deciphering the Interaction of 5,7‐Dihydroxyflavone with Hen‐Egg‐White Lysozyme through Multispectroscopic and Molecular Dynamics Simulation Approaches
Published in ChemistrySelect (Weinheim) (08-05-2018)“…In recent times, research based on the bio‐active flavonoid, chrysin has shown its potential therapeutic applications such as anti‐diabetic, neuroprotective,…”
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Computational multi-target approach to target essential enzymes of Leishmania donovani using comparative molecular dynamic simulations and MMPBSA analysis
Published in Phytochemical analysis (01-10-2023)“…Visceral leishmaniasis (VL) is caused by Leishmania donovani. The purine and pyrimidine pathways are essential for L. donovani. Simultaneously inhibiting…”
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Structural and functional premise of transport protein transthyretin in the sight of silver and zinc oxide nanoparticles through atomistic simulations
Published in Inorganica Chimica Acta (01-04-2024)“…[Display omitted] •Impact of inorganic nanoparticles on transthyretin and their fate on biological reactivity have been assessed.•The dynamic interaction of…”
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An integrative approach using systems biology, mutational analysis with molecular dynamics simulation to challenge the functionality of a target protein
Published in Chemical biology & drug design (01-06-2019)“…Visceral leishmaniasis affects millions of people worldwide in areas where Leishmania donovani is endemic. The protozoan species serves a greater threat as it…”
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Computational Analysis of the Silver Nanoparticle–Human Serum Albumin Complex
Published in ACS omega (14-01-2020)“…Drug delivery in excess concentrations and at not-specified sites inside the human body adversely affects the body and gives rise to other diseases. Several…”
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In silico Metabolic Pathway Analysis Identifying Target Against Leishmaniasis - A Kinetic Modeling Approach
Published in Frontiers in genetics (06-03-2020)“…The protozoan , from trypanosomatids family is a deadly human pathogen responsible for causing Visceral Leishmaniasis. Unavailability of proper treatment in…”
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Identification and analysis of structurally critical fragments in HopS2
Published in BMC bioinformatics (04-02-2019)“…Among the diverse roles of the Type III secretion-system (T3SS), one of the notable functions is that it serves as unique nano machineries in gram-negative…”
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Review on the Drug Intolerance and Vaccine Development for the Leishmaniasis
Published in Current drug targets (01-01-2023)“…Leishmaniasis is one of the Neglected Tropical Diseases (NTDs), a zoonotic disease of vector-borne nature that is caused by a protozoan parasite . This…”
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Amino acid interaction preferences in proteins
Published in Protein science (01-03-2010)“…Understanding the key factors that influence the interaction preferences of amino acids in the folding of proteins have remained a challenge. Here we present a…”
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Deciphering antiviral efficacy of malaria box compounds against malaria exacerbating viral pathogens- Epstein Barr virus and SARS-CoV-2, an in silico study
Published in Medicine in drug discovery (01-12-2022)“…In malaria endemic countries, coinfections and cotransmissions of different viral pathogens are widely reported. Prior studies have shown that malaria can…”
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Amino acid interaction preferences in helical membrane proteins
Published in Protein engineering, design and selection (01-08-2011)“…Membrane proteins are involved in a number of important biological functions. Yet, they are poorly understood from the structure and folding point of view. The…”
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A search for energy minimized sequences of proteins
Published in PloS one (19-08-2009)“…In this paper, we present numerical evidence that supports the notion of minimization in the sequence space of proteins for a target conformation. We use the…”
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Integrated subtractive genomics and structure-based approach to unravel the therapeutic drug target of Leishmania species
Published in Archives of microbiology (01-10-2024)“…Leishmaniasis is a complex vector-borne disease caused by intracellular protozoan parasites of the Leishmania genus. It presents a significant public health…”
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In silico analysis of antiviral phytochemicals efficacy against Epstein-Barr virus glycoprotein H
Published in Journal of biomolecular structure & dynamics (14-07-2022)“…Epstein-Barr virus is a tumor-associated, enveloped virus with glycoprotein receptor gHgL on its surface. gH attaches to epithelial or B cells and mediates…”
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Quorum Quenching: A Drug Discovery Approach Against Pseudomonas aeruginosa
Published in Microbiological research (01-11-2022)Get full text
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Lactoferrin adsorption onto silver nanoparticle interface: Implications of corona on protein conformation, nanoparticle cytotoxicity and the formulation adjuvanticity
Published in Chemical engineering journal (Lausanne, Switzerland : 1996) (01-04-2019)“…•BLf adsorption as corona reduces the cytotoxic propensity of AgNP.•BLf adsorption onto AgNP interface is predominantly enthalpically driven.•BLf in corona…”
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A Comprehensive Review of Drug Repurposing Strategies against Known Drug Targets of COVID-19
Published in COVID (01-02-2022)“…Drug repurposing is a more inexpensive and shorter approach than the traditional drug discovery and development process. The concept of identifying a potent…”
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Molecular scaffold recognition of drug molecules against essential genes of Leishmania donovani using biocomputing approach
Published in South African journal of botany (01-11-2023)“…•Essential genes (Pyridoxal kinase and sterol alpha-14 demethylase) are drug targets.•Discerned the atomistic interactions of small molecules with target…”
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