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Natali Di Russo
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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
1732012
The first step of the dioxygenation reaction carried out by tryptophan dioxygenase and indoleamine 2, 3-dioxygenase as revealed by quantum mechanical/molecular mechanical studies
L Capece, A Lewis-Ballester, D Batabyal, N Di Russo, SR Yeh, DA Estrin, ...
JBIC Journal of Biological Inorganic Chemistry 15, 811-823, 2010
662010
A high-spin square-planar Fe (II) complex stabilized by a trianionic pincer-type ligand and conclusive evidence for retention of geometry and spin state in solution
ME Pascualini, NV Di Russo, AE Thuijs, A Ozarowski, SA Stoian, ...
Chemical Science 6 (1), 608-612, 2015
522015
Underlying thermodynamics of pH-dependent allostery
NV Di Russo, MA Martí, AE Roitberg
The Journal of Physical Chemistry B 118 (45), 12818-12826, 2014
342014
Oxygen diffusion pathways in a cofactor-independent dioxygenase
NV Di Russo, HL Condurso, K Li, SD Bruner, AE Roitberg
Chemical science 6 (11), 6341-6348, 2015
192015
Oxygen Diffusion Pathways in a Cofactor-Independent Oxygenase
NV Di Russo, HA Condurso, SD Bruner, AE Roitberg
247th American Chemical Society Meeting and Exposition, 2014
192014
Oxygen Diffusion Pathways in a Cofactor-Independent Oxygenase
NV Di Russo, HA Condurso, SD Bruner, AA Roitberg
245th American Chemical Society Meeting and Exposition, 2013
192013
Synthesis and characterization of a family of M 2+ complexes supported by a trianionic ONO 3− pincer-type ligand: towards the stabilization of high-spin square-planar complexes
ME Pascualini, SA Stoian, A Ozarowski, NV Di Russo, AE Thuijs, ...
Dalton Transactions 44 (46), 20207-20215, 2015
142015
Synthesis, Characterization, and Reactivity of Iron(III) Complexes Supported by a Trianionic ONO3– Pincer Ligand
ME Pascualini, NV Di Russo, PA Quintero, AE Thuijs, D Pinkowicz, ...
Inorganic Chemistry 53 (24), 13078-13088, 2014
112014
Applicability of fluorescence-based sensors to the determination of kinetic parameters for O2 in oxygenases
NV Di Russo, SD Bruner, AE Roitberg
Analytical biochemistry 475, 53-55, 2015
32015
Computational Study of pH-Dependent Conformational Changes in Proteins
NV Di Russo, AE Roitberg
249th American Chemical Society Meeting and Exposition, 2015
2015
pH-dependent conformational changes in proteins: The case of Nitrophorin 4
N Di Russo, MA Marti, A Roitberg
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 248, 2014
2014
pH-dependent conformational changes in proteins: The case of Nitrophorin 4
NV Di Russo, DA Estrin, MA Marti, AE Roitberg
Sanibel Symposium, 2012
2012
Simulation of pH-dependent conformational changes in biomolecules
N Di Russo, Y Meng, MA Marti, DA Estrin, A Roitberg
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 238, 2009
2009
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Articles 1–14