关注
E. Laura Coitiño
E. Laura Coitiño
Prof. de Química Teórica&Computacional, Instituto de Quím. Biológica-Fac.Ciencias, UdelaR
在 fcien.edu.uy 的电子邮件经过验证
标题
引用次数
引用次数
年份
POLYRATE, version 9.7
JC Corchado, YY Chuang, PL Fast, WP Hu, YP Liu, GC Lynch, ...
University of Minnesota, Minneapolis, 2007
3392007
Reaction of hydrogen sulfide with disulfide and sulfenic acid to form the strongly nucleophilic persulfide
Cuevasanta, Ernesto, M Lange, J Bonanata, EL Coitiño, G FerrerSueta, ...
Journal of Biological Chemistry, 2015
3062015
POLYRATE-version 2008
http://comp. chem. umn. edu/polyrate/, 2008
277*2008
Molecular Mechanisms for the Reaction Between OH Radicals and Proline: Insights on the Role as Reactive Oxygen Species Scavenger in Plant Stress
S Signorelli, EL Coitiño, O Borsani, J Monza
The Journal of Physical Chemistry B 118 (1), 37-47, 2014
2042014
Gaussrate, version 2009-A
J Zheng, S Zhang, JC Corchado, YY Chuang, EL Coitino, BA Ellingson, ...
University of Minnesota: Minneapolis, MN, 2010
1802010
Interpolated variational transition-state theory by mapping
JC Corchado, EL Coitino, YY Chuang, PL Fast, DG Truhlar
The Journal of Physical Chemistry A 102 (14), 2424-2438, 1998
1671998
Polyrate-version 2017-C
J Zheng, JL Bao, R Meana-Pañeda, S Zhang, BJ Lynch, JC Corchado, ...
University of Minnesota, Minneapolis, MN, 2017
1632017
Connecting proline and γ-aminobutyric acid in stressed plants through non-enzymatic reactions
S Signorelli, PD Dans, EL Coitiño, O Borsani, J Monza
PLoS One 10 (3), e0115349, 2015
1492015
Polyrate-version 8.2
YY Chuang, JC Corchado, PL Fast, J Villa, EL Coitino, WP Hu, YP Liu, ...
University of Minnesota, Minneapolis, 1999
1311999
Polyrate
J Zheng, S Zhang, BJ Lynch, JC Corchado, YY Chuang, PL Fast, WP Hu, ...
University of Minnesota, Minneapolis, 2010
1202010
POLYRATE, version 7.0
R Steckler, YY Chuang, EL Coitino, WP Hu, YP Liu, GC Lynch, ...
University of Minnesota, Minneapolis, 1997
1111997
How should we calculate transition state geometries for radical reactions? The effect of spin contamination on the prediction of geometries for open-shell saddle points
YY Chuang, EL Coitiño, DG Truhlar
The Journal of Physical Chemistry A 104 (3), 446-450, 2000
1082000
Deconstructing the catalytic efficiency of peroxiredoxin-5 peroxidatic cysteine
S Portillo-Ledesma, F Sardi, B Manta, MV Tourn, A Clippe, B Knoops, ...
Biochemistry 53 (38), 6113-6125, 2014
952014
Gaussrate 17
J Zheng, JL Bao, S Zhang, JC Corchado, R Meana-Pañeda, YY Chuang, ...
University of Minnesota: Minneapolis, MN, 2017
872017
Gaussrate
J Zheng, S Zhang, JC Corchado, YY Chuang, EL Coitiño, BA Ellingson, ...
University of Minnesota, 2010
782010
Dual-Level Direct Dynamics Calculations of Deuterium and Carbon-13 Kinetic Isotope Effects for the Reaction Cl + CH4
O Roberto-Neto, EL Coitiño, DG Truhlar
The Journal of Physical Chemistry A 102 (24), 4568-4578, 1998
781998
Gaussrate, version 8.2
JC Corchado, YY Chunag, EL Coitino, DG Truhlar
University of Minnesota: Minneapolis, MN, 1999
731999
On the evaluation of the solvent polarization apparent charges in the polarizable continuum model: a new formulation
EL Coitiño, J Tomasi, R Cammi
Journal of Computational Chemistry 16 (1), 20-30, 1995
691995
The Chemical Basis of Thiol Addition to Nitro-Conjugated Linoleic Acid, a Protective Cell Signaling Lipid
L Turell, DA Vitturi, EL Coitiño, L Lebrato, MN Möller, C Sagasti, ...
Journal of Biological Chemistry 292 (4), 1145–1159, 2017
652017
The thiol of human serum albumin: acidity, microenvironment and mechanistic insights on its oxidation to sulfenic acid
J Bonanata, L Turell, L Antmann, B ... Álvarez, EL Coitiño
Free Radical Biol. Med., 2017
632017
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