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Rocha, Willian R
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1

Understanding the Enzyme (S)-Norcoclaurine Synthase Promisc..:

Salvatti, Brunno A. ; Chagas, Marcelo A. ; Fernandes, Phillipe O....
Journal of Chemical Information and Modeling.  64 (2024)  11 - p. 4462-4474 , 2024
Link: https://doi.org/10.1021/..
 
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2

New Hybrid Compound Candidate as Photothermal Agent Based o..:

Yoshinaga, Mariana ; Rocha, Willian R.
Photochemistry and Photobiology.  99 (2023)  6 - p. 1429-1437 , 2023
Link: https://doi.org/10.1111/..
 
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3

Calculation of Excited State Internal Conversion Rate Const..:

Bozzi, Aline S. ; Rocha, Willian R.
Journal of Chemical Theory and Computation.  , 2023
Link: https://doi.org/10.1021/..
 
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4

Theoretical investigation of [Ru(bpy)2(HAT)]2+ (HAT = 1,4,5..:

Castro Júnior, José Geraldo M. ; Rocha, Willian R.
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy.  270 (2022)  - p. 120817 , 2022
Link: https://doi.org/10.1016/..
 
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5

Nitric Oxide Reacts Very Fast with Hydrogen Sulfide, Alcoho..:

Neuman, Nicolas I. ; Venâncio, Mateus F. ; Rocha, Willian R....
Inorganic Chemistry.  60 (2021)  21 - p. 15997-16007 , 2021
Link: https://doi.org/10.1021/..
 
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6

Theoretical Investigation of the 4,5-Dibromorodamine Methyl..:

Yoshinaga, Mariana ; Rocha, Willian R.
The Journal of Physical Chemistry B.  125 (2021)  31 - p. 8932-8943 , 2021
Link: https://doi.org/10.1021/..
 
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7

Electronic structure and mechanism for the uptake of nitric..:

Pereira, Eufrásia S. ; Rodrigues, Gabriel L. S. ; Rocha, Willian R.
RSC Advances.  11 (2021)  13 - p. 7381-7390 , 2021
Link: https://doi.org/10.1039/..
 
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8

Non-structural protein 5 (NS5) as a target for antiviral de..:

Fernandes, Philipe O ; Chagas, Marcelo A ; Rocha, Willian R.
Current Opinion in Virology.  50 (2021)  - p. 30-39 , 2021
Link: https://doi.org/10.1016/..
 
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9

Computational insights into the reactivity of chlorpyrifos ..:

Quintano, Mateus M. ; Rocha, Willian R.
Journal of Molecular Modeling.  27 (2021)  10 - p. , 2021
Link: https://doi.org/10.1007/..
 
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10

Propene Hydroformylation Reaction Catalyzed by HRh(CO)(BISB..:

Neto, Daniel H. Cruz ; Dos Santos, Artur A. M. ; Da Silva, Júlio C. S...
European Journal of Inorganic Chemistry.  2020 (2020)  41 - p. 3907-3916 , 2020
Link: https://doi.org/10.1002/..
 
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11

Revisiting the Tropospheric OH-Initiated Unimolecular Decom..:

Quintano, Mateus M. ; Rodrigues, Gabriel L. S. ; Chagas, Marcelo A..
The Journal of Physical Chemistry A.  124 (2020)  21 - p. 4280-4289 , 2020
Link: https://doi.org/10.1021/..
 
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12

Nature of the bond, reduction potential, and solvation prop..:

Silva Rodrigues, Gabriel L. ; Rocha, Willian R.
International Journal of Quantum Chemistry.  121 (2020)  4 - p. , 2020
Link: https://doi.org/10.1002/..
 
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13

NO/H2S "Crosstalk" Reactions. The Role of Thionitrites (SNO..:

Marcolongo, Juan P. ; Venâncio, Mateus F. ; Rocha, Willian R...
Inorganic Chemistry.  58 (2019)  22 - p. 14981-14997 , 2019
Link: https://doi.org/10.1021/..
 
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14

Theoretical investigation of the neutral hydrolysis of diet..:

Chagas, Marcelo A. ; Pereira, Eufrásia S. ; Da Silva, Júlio Cosme S..
Journal of Molecular Modeling.  24 (2018)  9 - p. , 2018
Link: https://doi.org/10.1007/..
 
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15

Base Mechanism to the Hydrolysis of Phosphate Triester Prom..:

Chagas, Marcelo A. ; Pereira, Eufrásia S. ; Godinho, Marina P. B...
Inorganic Chemistry.  57 (2018)  10 - p. 5888-5902 , 2018
Link: https://doi.org/10.1021/..
 
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