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Mora-Diez, Nelaine
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1

Calculating the Aqueous pKa of Phenols: Predictions for Ant..:

Walton-Raaby, Max ; Floen, Tyler ; García-Díez, Guillermo.
Antioxidants.  12 (2023)  7 - p. 1420 , 2023
Link: https://doi.org/10.3390/..
 
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2

Contributors:

, In: Green Chemistry and Computational Chemistry,
Alimi, Kamel ; Amovilli, Claudio ; Antonio, Felipe C.T.... - p. xiii-xvii , 2022
Link: https://doi.org/10.1016/..
 
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3

Design of dyes for energy transformation: From the interact..:

, In: Green Chemistry and Computational Chemistry,
Homem-de-Mello, Paula ; Aono, Cassiano M. ; de Liandra-Salvador, Erica... - p. 79-114 , 2022
Link: https://doi.org/10.1016/..
 
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4

Complexes of Copper and Iron with Pyridoxamine, Ascorbic Ac..:

García-Díez, Guillermo ; Monreal-Corona, Roger ; Mora-Diez, Nelaine
Antioxidants.  10 (2021)  2 - p. 208 , 2021
Link: https://doi.org/10.3390/..
 
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5

Theoretical Study of the Iron Complexes with Lipoic and Dih..:

Monreal-Corona, Roger ; Biddlecombe, Jesse ; Ippolito, Angela.
Antioxidants.  9 (2020)  8 - p. 674 , 2020
Link: https://doi.org/10.3390/..
 
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6

Copolymerization of CHO/CO2 catalyzed by a series of alumin..:

Plommer, Hart ; Stein, Laura ; Murphy, Jennifer N....
Dalton Transactions.  49 (2020)  20 - p. 6884-6895 , 2020
Link: https://doi.org/10.1039/..
 
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7

Theoretical Study of the Iron Complexes with Aminoguanidine..:

García-Díez, Guillermo ; Mora-Diez, Nelaine
Antioxidants.  9 (2020)  8 - p. 756 , 2020
Link: https://doi.org/10.3390/..
 
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8

Theoretical study of copper complexes with lipoic and dihyd..:

Castañeda-Arriaga, Romina ; Alvarez-Idaboy, J. Raul ; Mora-Diez, Nelaine
RSC Advances.  6 (2016)  109 - p. 107924-107932 , 2016
Link: https://doi.org/10.1039/..
 
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9

Theoretical study of deuterium isotope effects on acid–base..:

Mora-Diez, Nelaine ; Egorova, Yulia ; Plommer, Hart.
RSC Advances.  5 (2015)  12 - p. 9097-9109 , 2015
Link: https://doi.org/10.1039/..
 
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10

Novel approach for predicting partition coefficients of lin..:

Hidalgo, Abdel ; Mora-Diez, Nelaine
Theoretical Chemistry Accounts.  135 (2015)  1 - p. , 2015
Link: https://doi.org/10.1007/..
 
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11

Thermodynamic stability of neutral and anionic PFOAs:

Hidalgo, Abdel ; Giroday, Thomas ; Mora-Diez, Nelaine
Theoretical Chemistry Accounts.  134 (2015)  11 - p. , 2015
Link: https://doi.org/10.1007/..
 
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12

Modelling the chemical repair of protein carbon-centered ra..:

Castañeda-Arriaga, Romina ; Mora-Diez, Nelaine ; Alvarez-Idaboy, J. Raul
RSC Advances.  5 (2015)  117 - p. 96714-96719 , 2015
Link: https://doi.org/10.1039/..
 
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13

Thermodynamic stability of PFOS: M06-2X and B3LYP compariso:

Giroday, Thomas ; Montero-Campillo, M. Merced ; Mora-Diez, Nelaine
Computational and Theoretical Chemistry.  1046 (2014)  - p. 81-92 , 2014
Link: https://doi.org/10.1016/..
 
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14

Theoretical study of the complex reaction of O(3P) with tra..:

Messaoudi, Boulanouar ; Mekelleche, Sidi Mohamed ; Alvarez-Idaboy, J. Raul.
Theoretical Chemistry Accounts.  132 (2013)  6 - p. , 2013
Link: https://doi.org/10.1007/..
 
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15

Acid-Catalyzed Nucleophilic Additions to Carbonyl Groups: I..:

Reyes, Lino ; Nicolás-Vázquez, Inés ; Mora-Diez, Nelaine.
The Journal of Organic Chemistry.  78 (2013)  6 - p. 2327-2335 , 2013
Link: https://doi.org/10.1021/..
 
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