Search Results - "Jr, Odonírio Abrahão"
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Biological evaluation and docking studies of natural isocoumarins as inhibitors for human kallikrein 5 and 7
Published in Bioorganic & medicinal chemistry letters (15-10-2011)“…Human kallikrein 5 and 7 (KLK5 and KLK7) are trypsin-like and chymotrypsin-like serine proteases, respectively, and promising targets for the treatment of skin…”
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Isomannide derivatives as new class of inhibitors for human kallikrein 7
Published in Bioorganic & medicinal chemistry letters (01-10-2012)“…Human kallikrein 7 (KLK7) is a potential target for the treatment of skin inflammation and cancer. Despite its potential, few KLK7-specific small-molecule…”
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Tyramine electropolymerization revisited by DFT and experimental study
Published in Journal of molecular structure (10-04-2013)“…[Display omitted] ► DFT study of tyramine intermediates formed under electropolymerization conditions. ► Detailing of the radicalar mechanism of tyramine…”
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ALX/FPR2 Activation by Stereoisomers of D1 Resolvins Elucidating with Molecular Dynamics Simulation
Published in The journal of physical chemistry. B (27-07-2023)“…Chronic inflammation contributes to several diseases, but its resolution is driven by specialized pro-resolving mediators (SPM) such as resolvin D1 (RvD1) and…”
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Insights into the Activation Mechanism of the ALX/FPR2 Receptor
Published in The journal of physical chemistry letters (05-11-2020)“…The formyl peptide receptor 2 (ALX/FPR2), a G-protein-coupled receptor (GPCR), plays an important role in host defense and inflammation. This receptor can be…”
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Molecular modeling study on the possible polymers formed during the electropolymerization of 3-hydroxyphenylacetic acid
Published in Journal of molecular graphics & modelling (01-04-2012)“…[Display omitted] ► DFT study on the electropolymerization of 3-hydroxy phenylacetic acid. ► Proposed reaction mechanism, based on theoretical and experimental…”
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Molecular modeling of bioactive neuropeptides: Substrates of angiotensin I-converting enzyme
Published in International journal of quantum chemistry (15-10-2012)“…Angiotensin I (Ang‐I)‐converting enzyme (ACE) is a chloride‐dependent zinc metallopeptidase that is important in the regulation of cardiovascular functions. In…”
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Gene identification and comparative molecular modeling of a Trypanosoma rangeli major surface protease
Published in Journal of molecular modeling (01-08-2013)“…Trypanosoma rangeli is a hemoflagellate parasite which is able to infect humans. Distinct from Trypanosoma cruzi , the causative agent of Chagas disease, T…”
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Electropolymerization mechanisms of hydroxyphenylacetic acid isomers
Published in Journal of molecular structure (25-08-2014)“…[Display omitted] •Electropolymerization of the three hydroxyphenylacetic acid isomers on graphite electrode, by voltammetry in acidic media.•DFT study of…”
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