Чланци са овлашћеним јавним приступом - Marcelo MartiСазнајте више
Није доступно нигде: 6
Best practices on QM/MM simulations of biological systems
CM Clemente, L Capece, MA Martí
Journal of Chemical Information and Modeling 63 (9), 2609-2627, 2023
Овлашћења: Government of Argentina
The underlying mechanism of HNO production by the myoglobin-mediated oxidation of hydroxylamine
L Álvarez, SA Suárez, PJ González, CD Brondino, F Doctorovich, ...
Inorganic Chemistry 59 (12), 7939-7952, 2020
Овлашћења: Government of Argentina
Solvent sites improve docking performance of protein–protein complexes and protein–protein interface-targeted drugs
GF Mayol, LA Defelipe, JP Arcon, AG Turjanski, MA Marti
Journal of Chemical Information and Modeling 62 (15), 3577-3588, 2022
Овлашћења: European Commission, Government of Argentina
Reaction of Amines with NO at room temperature and atmospheric pressure: is nitroxyl a reaction intermediate?
M Hamer, SA Suarez, M Muñoz, L Álvarez, M Marti, F Doctorovich
Pure and Applied Chemistry 92 (12), 2005-2014, 2020
Овлашћења: Government of Argentina
Specificity and Reactivity of Mycobacterium tuberculosis Serine/Threonine Kinases PknG and PknB
O Burastero, M Cabrera, ED Lopez, LA Defelipe, JP Arcon, R Durán, ...
Journal of Chemical Information and Modeling 62 (7), 1723-1733, 2022
Овлашћења: Government of Argentina
Monitoring Dynamic Conformations of a Single Fluorescent Molecule Inside a Protein Cavity
S Sosa, AM Szalai, LF Lopez, JM Prieto, C Zaza, AK Adamczyk, ...
Small Methods, 2402114, 2025
Овлашћења: European Commission, Human Frontier Science Program
Доступно негде: 116
H2S and NO cooperatively regulate vascular tone by activating a neuroendocrine HNO–TRPA1–CGRP signalling pathway
M Eberhardt, M Dux, B Namer, J Miljkovic, N Cordasic, C Will, TI Kichko, ...
Nature communications 5 (1), 4381, 2014
Овлашћења: German Research Foundation, Swedish Research Council, Government of Argentina
pH-Dependent Conformational Changes in Proteins and Their Effect on Experimental pKas: The Case of Nitrophorin 4
NV Di Russo, DA Estrin, MA Martí, AE Roitberg
PLoS computational biology 8 (11), e1002761, 2012
Овлашћења: US National Institutes of Health
Evidence for a ferryl intermediate in a heme-based dioxygenase
A Lewis-Ballester, D Batabyal, T Egawa, C Lu, Y Lin, MA Marti, L Capece, ...
Proceedings of the National Academy of Sciences 106 (41), 17371-17376, 2009
Овлашћења: US National Institutes of Health
The structural biology of galectin-ligand recognition: current advances in modeling tools, protein engineering, and inhibitor design
CP Modenutti, JIB Capurro, S Di Lella, MA Martí
Frontiers in Chemistry 7, 823, 2019
Овлашћења: Government of Argentina
Molecular dynamics in mixed solvents reveals protein–ligand interactions, improves docking, and allows accurate binding free energy predictions
JP Arcon, LA Defelipe, CP Modenutti, ED López, D Alvarez-Garcia, ...
Journal of chemical information and modeling 57 (4), 846-863, 2017
Овлашћења: Government of Spain, Government of Argentina
Trapping and Characterization of a Reaction Intermediate in Carbapenem Hydrolysis by B. cereus Metallo-β-lactamase
MF Tioni, LI Llarrull, AA Poeylaut-Palena, MA Martí, M Saggu, ...
Journal of the American Chemical Society 130 (47), 15852-15863, 2008
Овлашћења: US National Institutes of Health, Howard Hughes Medical Institute
The NtrY/X two‐component system of Brucella spp. acts as a redox sensor and regulates the expression of nitrogen respiration enzymes
MC Carrica, I Fernandez, MA Martí, G Paris, FA Goldbaum
Molecular microbiology 85 (1), 39-50, 2012
Овлашћења: Howard Hughes Medical Institute
Nitric oxide is reduced to HNO by proton-coupled nucleophilic attack by ascorbate, tyrosine, and other alcohols. A new route to HNO in biological media?
SA Suarez, NI Neuman, M Muñoz, L Álvarez, DE Bikiel, CD Brondino, ...
Journal of the American Chemical Society 137 (14), 4720-4727, 2015
Овлашћења: Government of Argentina
Complete reaction mechanism of indoleamine 2, 3-dioxygenase as revealed by QM/MM simulations
L Capece, A Lewis-Ballester, SR Yeh, DA Estrin, MA Marti
The Journal of Physical Chemistry B 116 (4), 1401-1413, 2012
Овлашћења: US National Institutes of Health
CG2AA: backmapping protein coarse-grained structures
LE Lombardi, MA Martí, L Capece
Bioinformatics 32 (8), 1235-1237, 2016
Овлашћења: Government of Argentina
Reactions of HNO with metal porphyrins: underscoring the biological relevance of HNO
F Doctorovich, DE Bikiel, J Pellegrino, SA Suárez, MA Martí
Accounts of chemical research 47 (10), 2907-2916, 2014
Овлашћења: Government of Argentina
Molecular Basis of Coupled Protein and Electron Transfer Dynamics of Cytochrome c in Biomimetic Complexes
D Alvarez-Paggi, DF Martín, PM DeBiase, P Hildebrandt, MA Martí, ...
Journal of the American Chemical Society 132 (16), 5769-5778, 2010
Овлашћења: German Research Foundation
Aromatic clusters in protein–protein and protein–drug complexes
E Lanzarotti, LA Defelipe, MA Marti, AG Turjanski
Journal of cheminformatics 12 (1), 30, 2020
Овлашћења: European Commission, Government of Argentina
Molecular Basis for the Electric Field Modulation of Cytochrome c Structure and Function
PM De Biase, DA Paggi, F Doctorovich, P Hildebrandt, DA Estrin, ...
Journal of the American Chemical Society 131 (44), 16248-16256, 2009
Овлашћења: German Research Foundation
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