Detalhe da pesquisa
1.
Catalytic Mechanism of Mycobacterium tuberculosis Methionine Sulfoxide Reductase A.
Biochemistry
; 63(4): 533-544, 2024 Feb 20.
Artigo
Inglês
| MEDLINE | ID: mdl-38286790
2.
Multiple oxidative post-translational modifications of human glutamine synthetase mediate peroxynitrite-dependent enzyme inactivation and aggregation.
J Biol Chem
; 299(3): 102941, 2023 03.
Artigo
Inglês
| MEDLINE | ID: mdl-36702251
3.
Mechanism of Peroxynitrite Interaction with Ferric M. tuberculosis Nitrobindin: A Computational Study.
Inorg Chem
; 63(21): 9907-9918, 2024 May 27.
Artigo
Inglês
| MEDLINE | ID: mdl-38754069
4.
Assessment of Embedding Schemes in a Hybrid Machine Learning/Classical Potentials (ML/MM) Approach.
J Chem Inf Model
; 64(10): 4047-4058, 2024 May 27.
Artigo
Inglês
| MEDLINE | ID: mdl-38710065
5.
Insights into the product release mechanism of dengue virus NS3 helicase.
Nucleic Acids Res
; 50(12): 6968-6979, 2022 07 08.
Artigo
Inglês
| MEDLINE | ID: mdl-35736223
6.
Autocatalytic Mechanism in the Anaerobic Reduction of Metmyoglobin by Sulfide Species.
Inorg Chem
; 62(29): 11304-11317, 2023 Jul 24.
Artigo
Inglês
| MEDLINE | ID: mdl-37439562
7.
Novel Lennard-Jones Parameters for Cysteine and Selenocysteine in the AMBER Force Field.
J Chem Inf Model
; 63(2): 595-604, 2023 01 23.
Artigo
Inglês
| MEDLINE | ID: mdl-36630702
8.
A Unique Mode of Coenzyme A Binding to the Nucleotide Binding Pocket of Human Metastasis Suppressor NME1.
Int J Mol Sci
; 24(11)2023 May 27.
Artigo
Inglês
| MEDLINE | ID: mdl-37298313
9.
Acidity and nucleophilic reactivity of glutathione persulfide.
J Biol Chem
; 295(46): 15466-15481, 2020 11 13.
Artigo
Inglês
| MEDLINE | ID: mdl-32873707
10.
Catalysis of Peroxide Reduction by Fast Reacting Protein Thiols.
Chem Rev
; 119(19): 10829-10855, 2019 10 09.
Artigo
Inglês
| MEDLINE | ID: mdl-31498605
11.
Structure and function of crocodilian hemoglobins and allosteric regulation by chloride, ATP, and CO2.
Am J Physiol Regul Integr Comp Physiol
; 318(3): R657-R667, 2020 03 01.
Artigo
Inglês
| MEDLINE | ID: mdl-32022587
12.
In Silico Insight into the Reductive Nitrosylation of Ferric Hemeproteins.
Inorg Chem
; 59(6): 3631-3641, 2020 Mar 16.
Artigo
Inglês
| MEDLINE | ID: mdl-32114760
13.
Spectroscopy in Complex Environments from QM-MM Simulations.
Chem Rev
; 118(7): 4071-4113, 2018 04 11.
Artigo
Inglês
| MEDLINE | ID: mdl-29561145
14.
Naturally occurring fluorescence in frogs.
Proc Natl Acad Sci U S A
; 114(14): 3672-3677, 2017 04 04.
Artigo
Inglês
| MEDLINE | ID: mdl-28289227
15.
Kinetics, subcellular localization, and contribution to parasite virulence of a Trypanosoma cruzi hybrid type A heme peroxidase (TcAPx-CcP).
Proc Natl Acad Sci U S A
; 114(8): E1326-E1335, 2017 02 21.
Artigo
Inglês
| MEDLINE | ID: mdl-28179568
16.
Ligand Binding Rate Constants in Heme Proteins Using Markov State Models and Molecular Dynamics Simulations.
Chemphyschem
; 20(19): 2451-2460, 2019 10 02.
Artigo
Inglês
| MEDLINE | ID: mdl-31365183
17.
Evaluation of quinoxaline compounds as ligands of a site adjacent to S2 (AS2) of cruzain.
Bioorg Med Chem Lett
; 29(16): 2197-2202, 2019 08 15.
Artigo
Inglês
| MEDLINE | ID: mdl-31257083
18.
Thermal Stability of Globins: Implications of Flexibility and Heme Coordination Studied by Molecular Dynamics Simulations.
J Chem Inf Model
; 59(1): 441-452, 2019 01 28.
Artigo
Inglês
| MEDLINE | ID: mdl-30516994
19.
Mechanism of Sulfide Binding by Ferric Hemeproteins.
Inorg Chem
; 57(13): 7591-7600, 2018 Jul 02.
Artigo
Inglês
| MEDLINE | ID: mdl-29916710
20.
A quantitative model for oxygen uptake and release in a family of hemeproteins.
Bioinformatics
; 32(12): 1805-13, 2016 06 15.
Artigo
Inglês
| MEDLINE | ID: mdl-27153569