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Molecular characterization of Escherichia coli O157:H7 strains isolated from different sources and geographic regions.
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- Journal of Veterinary Science, 2012, v. 13, n. 2, p. 139, doi. 10.4142/jvs.2012.13.2.139
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- Article
chem-path-tracker: An Automated Tool to Analyze Chemical Motifs in Molecular Structures.
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- Chemical Biology & Drug Design, 2014, v. 84, n. 1, p. 44, doi. 10.1111/cbdd.12349
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- Article
Volarea - A Bioinformatics Tool to Calculate the Surface Area and the Volume of Molecular Systems.
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- Chemical Biology & Drug Design, 2013, v. 82, n. 6, p. 743, doi. 10.1111/cbdd.12197
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- Article
A Molecular Perspective on Sirtuin Activity.
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- International Journal of Molecular Sciences, 2020, v. 21, n. 22, p. 8609, doi. 10.3390/ijms21228609
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- Article
Solving the Catalytic Mechanism of Tryptophan Synthase: an Emergent Drug Target in the Treatment of Tuberculosis.
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- ChemCatChem, 2020, v. 12, n. 1, p. 227, doi. 10.1002/cctc.201901505
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- Article
Cover Feature: Protocol for Computational Enzymatic Reactivity Based on Geometry Optimisation (ChemPhysChem 6/2018).
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- ChemPhysChem, 2018, v. 19, n. 6, p. 667, doi. 10.1002/cphc.201800166
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- Article
Protocol for Computational Enzymatic Reactivity Based on Geometry Optimisation.
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- ChemPhysChem, 2018, v. 19, n. 6, p. 669, doi. 10.1002/cphc.201700339
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- Article
Antimicrobial resistance, integron carriage, and gyrA and gyrB mutations in Pseudomonas aeruginosa isolated from dogs with otitis externa and pyoderma in Brazil.
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- Veterinary Dermatology, 2016, v. 27, n. 2, p. 113, doi. 10.1111/vde.12290
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- Article
Identification of Crucial Amino Acids in Mouse Aldehyde Oxidase 3 That Determine Substrate Specificity.
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- PLoS ONE, 2013, v. 8, n. 12, p. 1, doi. 10.1371/journal.pone.0082285
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- Article
MADAMM: A multistaged docking with an automated molecular modeling protocol.
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- Proteins, 2009, v. 74, n. 1, p. 192, doi. 10.1002/prot.22146
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- Article
An Unsual Cys‐Glu‐Lys Catalytic Triad is Responsible for the Catalytic Mechanism of the Nitrilase Superfamily: A QM/MM Study on Nit2.
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- ChemPhysChem, 2021, v. 22, n. 8, p. 796, doi. 10.1002/cphc.202000751
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- Article
Synthesis and Reactivity of Photochromic 2H-Chromenes Based on 3-Carboxylated Coumarins.
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- Helvetica Chimica Acta, 2003, v. 86, n. 9, p. 3244
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- Article
Synthesis of Photochromic Dyes Based on Annulated Coumarin Systems.
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- Helvetica Chimica Acta, 2002, v. 85, n. 2, p. 442, doi. 10.1002/1522-2675(200202)85:2<442::AID-HLCA442>3.0.CO;2-9
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- Article
Visualizing the Microscopic World.
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- Interdisciplinary Sciences: Computational Life Sciences, 2018, v. 10, n. 1, p. 105, doi. 10.1007/s12539-017-0255-2
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- Article
Inactivation Mechanism of the Fatty Acid Amide Hydrolase Inhibitor BIA 10‐2474.
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- ChemBioChem, 2022, v. 23, n. 20, p. 1, doi. 10.1002/cbic.202200166
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- Article
The Catalytic Mechanism of Pdx2 Glutaminase Driven by a Cys-His-Glu Triad: A Computational Study.
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- ChemBioChem, 2022, v. 23, n. 9, p. 1, doi. 10.1002/cbic.202100555
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- Article
Development and production of a CNC machined 420 stainless steel reinforced with Cu by hot pressing.
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- Journal of Materials Science, 2023, v. 58, n. 11, p. 5048, doi. 10.1007/s10853-023-08332-7
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- Article
A Molecular Mechanics Energy Partitioning Software for Biomolecular Systems.
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- Molecules, 2022, v. 27, n. 17, p. 5524, doi. 10.3390/molecules27175524
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- Article
Ultrasonic-assisted dispersive liquid–liquid microextraction (US DLLME) of zinc in Brazilian sugarcane spirit samples.
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- Journal of the Iranian Chemical Society, 2021, v. 18, n. 3, p. 603, doi. 10.1007/s13738-020-02045-3
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- Article
Studies on neuraminidase inhibition.
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- International Journal of Quantum Chemistry, 2018, v. 118, n. 9, p. 1, doi. 10.1002/qua.25592
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- Article
Enzymatic 'tricks': Carboxylate shift and sulfur shift.
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- International Journal of Quantum Chemistry, 2014, v. 114, n. 19, p. 1253, doi. 10.1002/qua.24689
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- Article
Molecular determinants of ligand specificity in family 11 carbohydrate binding modules – an NMR, X-ray crystallography and computational chemistry approach.
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- FEBS Journal, 2008, v. 275, n. 10, p. 2524, doi. 10.1111/j.1742-4658.2008.06401.x
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- Article
The Catalytic Mechanism of the Pyridoxal-5′-phosphate-Dependent Enzyme, Histidine Decarboxylase: A Computational Study.
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- Chemistry - A European Journal, 2017, v. 23, n. 38, p. 9162, doi. 10.1002/chem.201701375
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- Article
Alkaline phosphatase dual‐binding sites for collagen dictate cell migration and microvessel assembly in vitro.
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- Journal of Cellular Biochemistry, 2021, v. 122, n. 1, p. 116, doi. 10.1002/jcb.29835
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- Article
Understanding Ribonucleotide Reductase Inactivation by Gemcitabine.
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- Chemistry - A European Journal, 2007, v. 13, n. 30, p. 8507, doi. 10.1002/chem.200700260
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- Article
Laser patterning of amorphous silicon thin films deposited on flexible and rigid substrates.
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- Physica Status Solidi. A: Applications & Materials Science, 2016, v. 213, n. 7, p. 1717, doi. 10.1002/pssa.201532980
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- Article
Raman study of insulating and conductive ZnO:(Al, Mn) thin films.
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- Physica Status Solidi. A: Applications & Materials Science, 2015, v. 212, n. 10, p. 2345, doi. 10.1002/pssa.201532162
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- Article
Application of quantum mechanics/molecular mechanics methods in the study of enzymatic reaction mechanisms.
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- WIREs: Computational Molecular Science, 2017, v. 7, n. 2, p. n/a, doi. 10.1002/wcms.1281
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- Article
The effect of the sixth sulfur ligand in the catalytic mechanism of periplasmic nitrate reductase.
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- Journal of Computational Chemistry, 2009, v. 30, n. 15, p. 2466, doi. 10.1002/jcc.21280
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- Article
Ribonucleotide activation by enzyme ribonucleotide reductase: Understanding the role of the enzyme.
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- Journal of Computational Chemistry, 2004, v. 25, n. 16, p. 2031, doi. 10.1002/jcc.20127
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- Article
Montelukast and cefoperazone act as antiquorum sensing and antibiofilm agents against Pseudomonas aeruginosa.
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- Journal of Applied Microbiology, 2024, v. 135, n. 5, p. 1, doi. 10.1093/jambio/lxae088
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- Article
An Atomic-Level Perspective of HMG-CoA-Reductase: The Target Enzyme to Treat Hypercholesterolemia.
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- Molecules, 2020, v. 25, n. 17, p. 3891, doi. 10.3390/molecules25173891
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- Article
Formation of Unstable and very Reactive Chemical Species Catalyzed by Metalloenzymes: A Mechanistic Overview.
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- Molecules, 2019, v. 24, n. 13, p. 2462, doi. 10.3390/molecules24132462
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- Article
IMPORTÂNCIA DO PÚBLICO NO FUTEBOL: UMA ANÁLISE PRÉ E DURANTE A PANDEMIA DO COVID-19.
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- Brazilian Journal of Soccer Science / Revista Brasileira de Futebol, 2022, v. 15, n. 2, p. 36
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- Article
JOGAR EM CASA PODE INFLUENCIAR NO RESULTADO DO JOGO?
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- Brazilian Journal of Soccer Science / Revista Brasileira de Futebol, 2022, v. 15, n. 2, p. 34
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- Article
Computational studies on class I ribonucleotide reductase: understanding the mechanisms of action and inhibition of a cornerstone enzyme for the treatment of cancer.
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- European Biophysics Journal, 2006, v. 35, n. 3, p. 125, doi. 10.1007/s00249-005-0026-6
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- Article
New insights into the catalytic mechanism of the SARS-CoV-2 main protease: an ONIOM QM/MM approach.
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- Molecular Diversity, 2022, v. 26, n. 3, p. 1373, doi. 10.1007/s11030-021-10259-7
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- Article
Vapor grown carbon nanofiber based cotton fabrics with negative thermoelectric power.
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- Cellulose, 2020, v. 27, n. 15, p. 9091, doi. 10.1007/s10570-020-03391-4
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- Article
Periplasmic nitrate reductase revisited: a sulfur atom completes the sixth coordination of the catalytic molybdenum.
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- Journal of Biological Inorganic Chemistry (JBIC), 2008, v. 13, n. 5, p. 737, doi. 10.1007/s00775-008-0359-6
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- Article
Unravelling the Olfactory Sense: From the Gene to Odor Perception.
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- Chemical Senses, 2016, v. 41, n. 2, p. 105, doi. 10.1093/chemse/bjv075
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- Article
Antimicrobial Resistance in Farm Animals in Brazil: An Update Overview.
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- Animals (2076-2615), 2020, v. 10, n. 4, p. 552, doi. 10.3390/ani10040552
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- Article
Dielectric spectroscopy of melt-extruded polypropylene and as-grown carbon nanofiber composites.
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- European Physical Journal E -- Soft Matter, 2021, v. 44, n. 5, p. 1, doi. 10.1140/epje/s10189-021-00079-w
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- Article
vsLab-An implementation for virtual high-throughput screening using AutoDock and VMD.
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- International Journal of Quantum Chemistry, 2011, v. 111, n. 6, p. 1208, doi. 10.1002/qua.22738
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- Article
Carbohydrate-binding modules from family 11: Understanding the binding mode of polysaccharides.
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- International Journal of Quantum Chemistry, 2008, v. 108, n. 11, p. 2030, doi. 10.1002/qua.21755
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- Article
molUP: A VMD plugin to handle QM and ONIOM calculations using the gaussian software.
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- Journal of Computational Chemistry, 2018, v. 39, n. 19, p. 1344, doi. 10.1002/jcc.25189
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- Article