Search Results - "Galano, Annia"
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On the direct scavenging activity of melatonin towards hydroxyl and a series of peroxyl radicals
Published in Physical chemistry chemical physics : PCCP (01-01-2011)“…The reactions of melatonin (MLT) with hydroxyl and several peroxyl radicals have been studied using the Density Functional Theory, specifically the M05-2X…”
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Melatonin and its metabolites vs oxidative stress: From individual actions to collective protection
Published in Journal of pineal research (01-08-2018)“…Oxidative stress (OS) represents a threat to the chemical integrity of biomolecules including lipids, proteins, and DNA. The associated molecular damage…”
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Relative Antioxidant Efficiency of a Large Series of Carotenoids in Terms of One Electron Transfer Reactions
Published in The journal of physical chemistry. B (08-11-2007)“…The relative antioxidant efficiency, expressed as electron donating capability, of a large series of carotenoids has been studied using density functional…”
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Computational strategies for predicting free radical scavengers' protection against oxidative stress: Where are we and what might follow?
Published in International journal of quantum chemistry (15-01-2019)“…Oxidative stress, which is frequently induced by an overproduction of free radicals (FR), poses a high risk to human health. Thus, finding efficient strategies…”
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Melatonin: exceeding expectations
Published in Physiology (Bethesda, Md.) (01-09-2014)“…Melatonin is a small, highly conserved indole with numerous receptor-mediated and receptor-independent actions. Receptor-dependent functions include circadian…”
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On the free radical scavenging activities of melatonin's metabolites, AFMK and AMK
Published in Journal of pineal research (01-04-2013)“…The reactions of N1‐acetyl‐N2‐formyl‐5‐methoxykynuramine (AFMK) and N1‐acetyl‐5‐methoxykynuramine (AMK) with •OH, •OOH, and •OOCCl3 radicals have been studied…”
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7
Melatonin as a natural ally against oxidative stress: a physicochemical examination
Published in Journal of pineal research (01-08-2011)“…: Oxidative stress has been proven to be related to the onset of a large number of health disorders. This chemical stress is triggered by an excess of free…”
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A computational methodology for accurate predictions of rate constants in solution: Application to the assessment of primary antioxidant activity
Published in Journal of computational chemistry (30-10-2013)“…The accurate prediction of rate constants for chemical reactions in solution, using computational methods, is a challenging task. In this work, a computational…”
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Melatonin as a mitochondria-targeted antioxidant: one of evolution’s best ideas
Published in Cellular and molecular life sciences : CMLS (01-11-2017)“…Melatonin is an ancient antioxidant. After its initial development in bacteria, it has been retained throughout evolution such that it may be or may have been…”
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Kinetics of radical-molecule reactions in aqueous solution: A benchmark study of the performance of density functional methods
Published in Journal of computational chemistry (30-10-2014)“…The performance of 18 density functional approximations has been tested for a very challenging task, the calculations of rate constants for radical‐molecule…”
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Melatonin: A Versatile Protector against Oxidative DNA Damage
Published in Molecules (Basel, Switzerland) (27-02-2018)“…Oxidative damage to DNA has important implications for human health and has been identified as a key factor in the onset and development of numerous diseases…”
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Carbon nanotubes: promising agents against free radicals
Published in Nanoscale (01-01-2010)“…The potential role of carbon nanotubes (CNTs) as free-radical scavengers is still an emerging area of research. So far some promising results have been…”
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Eyringpy: A program for computing rate constants in the gas phase and in solution
Published in International journal of quantum chemistry (15-01-2019)“…Eyringpy is a modular program for calculating thermochemical properties and rate constants for reactions in the gas phase and in solution. The code is written…”
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14
Phytomelatonin: assisting plants to survive and thrive
Published in Molecules (22-04-2015)“…This review summarizes the advances that have been made in terms of the identified functions of melatonin in plants. Melatonin is an endogenously-produced…”
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Ellagic Acid: An Unusually Versatile Protector against Oxidative Stress
Published in Chemical research in toxicology (19-05-2014)“…Several aspects related to the antioxidant activity of ellagic acid were investigated using the density functional theory. It was found that this compound is…”
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Comprehensive Investigation of the Antioxidant and Pro-oxidant Effects of Phenolic Compounds: A Double-Edged Sword in the Context of Oxidative Stress?
Published in The journal of physical chemistry. B (14-06-2018)“…Oxidative stress (OS) is a health-threatening process that is involved, at least partially, in the development of several diseases. Although antioxidants can…”
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17
Melatonin Mitigates Mitochondrial Meltdown: Interactions with SIRT3
Published in International journal of molecular sciences (18-08-2018)“…Melatonin exhibits extraordinary diversity in terms of its functions and distribution. When discovered, it was thought to be uniquely of pineal gland origin…”
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On the influence of diameter and length on the properties of armchair single-walled carbon nanotubes: A theoretical chemistry approach
Published in Chemical physics (21-08-2006)“…Open-ended fragments of armchair single-walled carbon nanotubes ( n, n) with n = 3, 4, 5, and 6, have been modeled, with increasing lengths from 0.6 to 3 nm…”
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On the Chemical Repair of DNA Radicals by Glutathione: Hydrogen vs Electron Transfer
Published in The journal of physical chemistry. B (09-08-2012)“…The chemical repair of radical-damaged DNA by glutathione in aqueous solution has been studied using density functional theory. Two main mechanisms were…”
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Guanosine + OH Radical Reaction in Aqueous Solution: A Reinterpretation of the UV−vis Data Based on Thermodynamic and Kinetic Calculations
Published in Organic letters (19-11-2009)“…Thermodynamic and kinetic calculations have been used to reinterpret the UV−vis data related to the OH radical oxidation of guanosine. The main channel of…”
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