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1

Rethinking the applicability domain analysis in QSAR models:

Mora, Jose R. ; Marquez, Edgar A. ; Pérez-Pérez, Noel...
Journal of Computer-Aided Molecular Design. 38 (2024) 1 - p. , 2024

Link: https://doi.org/10.1007/..

2

Exploring the dynamics of the ABCB1 membrane transporter P-..:

Mora Lagares, Liadys ; Pérez-Castillo, Yunierkis ; Novič, Marjana
Toxicology. 502 (2024) - p. 153732 , 2024

Link: https://doi.org/10.1016/..

3

Multiquery Similarity Searching Models: An Alternative Appr..:

Castillo-Mendieta, Kevin ; Agüero-Chapin, Guillermin ; Marquez, Edgar...
Chemical Research in Toxicology. 37 (2024) 4 - p. 580-589 , 2024

Link: https://doi.org/10.1021/..

4

Exploring Target Identification for Drug Design with K-Near..:

, In: Artificial Intelligence and Soft Computing; Lecture Notes in Computer Science,

Jimenes-Vargas, Karina ; Perez-Castillo, Yunierkis ; Tejera, Eduardo. - p. 219-227 , 2023

Link: https://doi.org/10.1007/..

5

Antifungal activity against Candida albicans of methyl 3,5-..:

Duarte, Allana Brunna Sucupira ; Perez-Castillo, Yunierkis ; da Nóbrega Alves, Danielle...
Brazilian Journal of Microbiology. 55 (2023) 1 - p. 25-39 , 2023

Link: https://doi.org/10.1007/..

6

Degradation of PET Bottles by an Engineered Ideonella sakai..:

Sevilla, Maria Eduarda ; Garcia, Mario D. ; Perez-Castillo, Yunierkis...
Polymers. 15 (2023) 7 - p. 1779 , 2023

Link: https://doi.org/10.3390/..

7

Modeling defensive functions of alkaloids within diverse ch..:

Yeager, Justin ; Viteri Chancusi, Pablo Andres ; Perez-Castillo, Yunierkis..
Evolutionary Ecology. , 2023

Link: https://doi.org/10.1007/..

8

Molecular Modeling and In Vitro Evaluation of Piplartine An..:

Silva, Rayanne H. N. ; Machado, Thaíssa Q. ; da Fonseca, Anna Carolina C....
Molecules. 28 (2023) 4 - p. 1675 , 2023

Link: https://doi.org/10.3390/..

9

Synthetic Cinnamides and Cinnamates: Antimicrobial Activity..:

de Morais, Mayara Castro ; de Oliveira Lima, Edeltrudes ; Perez-Castillo, Yunierkis.
Molecules. 28 (2023) 4 - p. 1918 , 2023

Link: https://doi.org/10.3390/..

10

From a coenzyme-like mechanism to homochirality:

Martín, Osmel ; Leyva, Yoelsy ; Suárez-Lezcano, José..
Biosystems. 227-228 (2023) - p. 104904 , 2023

Link: https://doi.org/10.1016/..

11

Antileishmanial activity of 5-nitroindazole derivatives:

Mollineda-Diogo, Niurka ; Chaviano-Montes de Oca, Claudia Sissely ; Sifontes-Rodríguez, Sergio...
Therapeutic Advances in Infectious Disease. 10 (2023) - p. , 2023

Link: https://doi.org/10.1177/..

12

Piplartine Synthetic Analogs: In Silico Analysis and Antipa..:

Silva, Rayanne H. N. ; Magalhães, Emanuel P. ; Gomes, Rebeca C....
Applied Sciences. 13 (2023) 20 - p. 11585 , 2023

Link: https://doi.org/10.3390/..

13

Antileishmanial Activity of Cinnamic Acid Derivatives again..:

de Morais, Mayara Castro ; Medeiros, Gisele Alves ; Almeida, Fernanda Silva...
Molecules. 28 (2023) 6 - p. 2844 , 2023

Link: https://doi.org/10.3390/..

14

Elucidating the Racemization Mechanism of Aliphatic and Aro..:

Andino, Mateo S. ; Mora, José R. ; Paz, José L....
International Journal of Molecular Sciences. 24 (2023) 15 - p. 11877 , 2023

Link: https://doi.org/10.3390/..

15

Metabolomic profile and computational analysis for the iden..:

Beltrán-Noboa, Andrea ; Proaño-Ojeda, John ; Guevara, Mabel...
Food and Chemical Toxicology. 164 (2022) - p. 113039 , 2022

Link: https://doi.org/10.1016/..

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