Search Results - "de Lima Menezes, Gabriela"
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Quantum mechanics insights into melatonin and analogs binding to melatonin MT1 and MT2 receptors
Published in Scientific reports (13-05-2024)“…Melatonin receptors MT 1 and MT 2 are G protein-coupled receptors that mediate the effects of melatonin, a hormone involved in circadian rhythms and other…”
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Antiviral Activity of Quercetin Hydrate against Zika Virus
Published in International journal of molecular sciences (01-04-2023)“…Zika virus (ZIKV) has re-emerged in recent decades, leading to outbreaks of Zika fever in Africa, Asia, and Central and South America. Despite its drastic…”
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Predicting Antigenic Peptides from Rocio Virus NS1 Protein for Immunodiagnostic Testing Using Immunoinformatics and Molecular Dynamics Simulation
Published in International journal of molecular sciences (12-07-2022)“…The mosquito-borne disease caused by the Rocio virus is a neglected threat, and new immune inputs for serological testing are urgently required for diagnosis…”
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Rocio Virus: An Updated View on an Elusive Flavivirus
Published in Viruses (16-11-2021)“…Rocio virus (ROCV) is a mosquito-borne flavivirus and human pathogen. The virus is indigenous to Brazil and was first detected in 1975 in the Sao Paulo State,…”
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Antiviral Activity and Molecular Dynamics Simulation of Hops Compounds against Oropouche Virus ( Peribunyaviridae )
Published in Pharmaceutics (01-12-2023)“…The Oropouche virus (OROV) is a member of the family (order ) and the cause of a dengue-like febrile illness transmitted mainly by biting midges and…”
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Structural Insights into Plasticity and Discovery of Flavonoid Allosteric Inhibitors of Flavivirus NS2B–NS3 Protease
Published in Biophysica (01-03-2023)“…Flaviviruses are among the most critical pathogens in tropical regions; they cause various severe diseases in developing countries but are not restricted to…”
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Mycobacterium bovis PknG R242P Mutation Results in Structural Changes with Enhanced Virulence in the Mouse Model of Infection
Published in Microorganisms (Basel) (22-03-2022)“…is the causative agent of tuberculosis in domestic and wild animal species and sometimes in humans, presenting variable degrees of pathogenicity. It is known…”
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Exploring Quercetin Hydrate’s Potential as an Antiviral Treatment for Oropouche Virus
Published in Biophysica (01-09-2023)“…The Oropouche virus is an orthobunyavirus responsible for causing Oropouche fever, a disease that primarily affects thousands of people in South and Central…”
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Virtual screening of small natural compounds against NS1 protein of DENV, YFV and ZIKV
Published in Journal of biomolecular structure & dynamics (03-05-2023)“…Diseases caused by viruses of the genus Flavivirus are among the main diseases that affect the world and they are a serious public health problem. Three of…”
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Quantum mechanical analysis of newly synthesized HIV-1 protease inhibitors: evaluation of wild-type and resistant strain binding interactions
Published in Physical chemistry chemical physics : PCCP (30-10-2024)“…Inhibition of HIV-1 protease is a cornerstone of antiretroviral therapy. However, the notorious ability of HIV-1 to develop resistance to protease inhibitors…”
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Serine proteases in neutrophil extracellular traps exhibit anti-Respiratory Syncytial Virus activity
Published in International immunopharmacology (01-05-2022)“…[Display omitted] •Isolated neutrophilic serine proteases posses anti-hRSV effets.•Elastase, Proteinase 3 and Cathepsin G have in-vitro virucidal anti-hRSV…”
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Dynamic behavior of Dengue and Zika viruses NS1 protein reveals monomer-monomer interaction mechanisms and insights to rational drug design
Published in Journal of biomolecular structure & dynamics (21-09-2020)“…Communicated by Ramaswamy H. Sarma…”
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Novel computational and drug design strategies for the inhibition of human T-cell leukemia virus 1-associated lymphoma by Astilbin derivatives
Published in Journal of biomolecular structure & dynamics (22-12-2023)“…Human T-cell leukemia virus 1 (HTLV-1) associated lymphoma is a devastating malignancy triggered by HTLV-1 infections. We employeda comprehensive drug design…”
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Prediction of MAYV peptide antigens for immunodiagnostic tests by immunoinformatics and molecular dynamics simulations
Published in Scientific reports (16-09-2019)“…The Mayaro virus is endemic to South America, and the possible involvement of Aedes spp. mosquitoes in its transmission is a risk factor for outbreaks of…”
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Caffeic Acid Has Antiviral Activity against Ilhéus Virus In Vitro
Published in Viruses (01-02-2023)“…Ilhéus virus (ILHV) is a neglected mosquito-borne flavivirus. ILHV infection may lead to Ilhéus fever, an emerging febrile disease like dengue fever with the…”
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The search for an antiviral lead molecule to combat the neglected emerging Oropouche virus
Published in Current research in microbial sciences (01-01-2024)“…•Oropouche virus (OROV) is the causative agent of a dengue-like febrile illness transmitted by mosquitoes with epidemic potential.•Wedelolactone (WDL) is a…”
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Acridones as promising drug candidates against Oropouche virus
Published in Current research in microbial sciences (01-01-2024)“…•Acridones are identified as a novel antiviral for OROV infection in vitro.•This potency is attributed to the interaction of FAC21 with the OROV…”
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Identification of potential drugs against SARS-CoV-2 non-structural protein 1 (nsp1)
Published in Journal of biomolecular structure & dynamics (02-09-2021)“…Non-structural protein 1 (nsp1) is found in all Betacoronavirus genus, an important viral group that causes severe respiratory human diseases. This protein has…”
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MPO interacts with hRSV particles, contributing to the virucidal effects of NETs against clinical and laboratory hRSV isolates
Published in International journal of biological macromolecules (01-12-2024)“…Human Respiratory syncytial virus (hRSV) mainly affects immunosuppressed patients requiring hospitalization. No specific treatment is financially accessible,…”
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ZIKV B-cell epitopes for immunodiagnostic tests
Published in Journal of immunological methods (01-05-2022)“…The use of serological tests is valuable to diagnose Zika virus (ZIKV) infection and carry out epidemiological surveillance. However, ZIKV serological tests…”
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