González Barrios A - Search Results

1

Discovery of new potential CDK2/VEGFR2 type II inhibitors by fragmentation and virtual screening of natural products.

Vásquez AF, Reyes Muñoz A, Duitama J, González Barrios A. Vásquez AF, et al. Among authors: gonzalez barrios a. J Biomol Struct Dyn. 2021 Jun;39(9):3285-3299. doi: 10.1080/07391102.2020.1763839. Epub 2020 May 13. J Biomol Struct Dyn. 2021. PMID: 32362218

2

Pushing the Ligand Efficiency Metrics: Relative Group Contribution (RGC) Model as a Helpful Strategy to Promote a Fragment "Rescue" Effect.

Vásquez AF, González Barrios A. Vásquez AF, et al. Among authors: gonzalez barrios a. Front Chem. 2019 Aug 16;7:564. doi: 10.3389/fchem.2019.00564. eCollection 2019. Front Chem. 2019. PMID: 31482085 Free PMC article.

3

Classical MD and metadynamics simulations on back-pocket binders of CDK2 and VEGFR2: a guidepost to design novel small-molecule dual inhibitors.

Vásquez AF, González Barrios AF. Vásquez AF, et al. J Biomol Struct Dyn. 2022;40(19):9030-9041. doi: 10.1080/07391102.2021.1922311. Epub 2021 May 5. J Biomol Struct Dyn. 2022. PMID: 33949282

4

Non-Extensive Fragmentation of Natural Products and Pharmacophore-Based Virtual Screening as a Practical Approach to Identify Novel Promising Chemical Scaffolds.

Vásquez AF, Muñoz AR, Duitama J, González Barrios A. Vásquez AF, et al. Among authors: gonzalez barrios a. Front Chem. 2021 Aug 2;9:700802. doi: 10.3389/fchem.2021.700802. eCollection 2021. Front Chem. 2021. PMID: 34422762 Free PMC article.

5

Unraveling the Genome of a High Yielding Colombian Sugarcane Hybrid.

Trujillo-Montenegro JH, Rodríguez Cubillos MJ, Loaiza CD, Quintero M, Espitia-Navarro HF, Salazar Villareal FA, Viveros Valens CA, González Barrios AF, De Vega J, Duitama J, Riascos JJ. Trujillo-Montenegro JH, et al. Front Plant Sci. 2021 Aug 13;12:694859. doi: 10.3389/fpls.2021.694859. eCollection 2021. Front Plant Sci. 2021. PMID: 34484261 Free PMC article.

6

Lipidomic profiling of bioactive lipids during spontaneous fermentations of fine-flavor cocoa.

Herrera-Rocha F, Cala MP, León-Inga AM, Aguirre Mejía JL, Rodríguez-López CM, Florez SL, Chica MJ, Olarte HH, Duitama J, González Barrios AF, Fernández-Niño M. Herrera-Rocha F, et al. Food Chem. 2022 Dec 15;397:133845. doi: 10.1016/j.foodchem.2022.133845. Epub 2022 Aug 2. Food Chem. 2022. PMID: 35940096

7

Novel covalent and non-covalent complex-based pharmacophore models of SARS-CoV-2 main protease (M^pro) elucidated by microsecond MD simulations.

Hayek-Orduz Y, Vásquez AF, Villegas-Torres MF, Caicedo PA, Achenie LEK, González Barrios AF. Hayek-Orduz Y, et al. Among authors: gonzalez barrios af. Sci Rep. 2022 Aug 18;12(1):14030. doi: 10.1038/s41598-022-17204-0. Sci Rep. 2022. PMID: 35982147 Free PMC article.

8

Identification of Active Compounds against Melanoma Growth by Virtual Screening for Non-Classical Human DHFR Inhibitors.

Vásquez AF, Gómez LA, González Barrios A, Riaño-Pachón DM. Vásquez AF, et al. Among authors: gonzalez barrios a. Int J Mol Sci. 2022 Nov 11;23(22):13946. doi: 10.3390/ijms232213946. Int J Mol Sci. 2022. PMID: 36430425 Free PMC article.

9

New Therapeutic Candidates for the Treatment of Malassezia pachydermatis -Associated Infections.

Sastoque A, Triana S, Ehemann K, Suarez L, Restrepo S, Wösten H, de Cock H, Fernández-Niño M, González Barrios AF, Celis Ramírez AM. Sastoque A, et al. Among authors: gonzalez barrios af. Sci Rep. 2020 Mar 17;10(1):4860. doi: 10.1038/s41598-020-61729-1. Sci Rep. 2020. PMID: 32184419 Free PMC article.

10

Saccharomyces cerevisiae biofactory to produce naringenin using a systems biology approach and a bicistronic vector expression strategy in flavonoid production.

Mejía-Manzano LA, Ortiz-Alcaráz CI, Parra Daza LE, Suarez Medina L, Vargas-Cortez T, Fernández-Niño M, González Barrios AF, González-Valdez J. Mejía-Manzano LA, et al. Among authors: gonzalez barrios af. Microbiol Spectr. 2024 Jan 11;12(1):e0337423. doi: 10.1128/spectrum.03374-23. Epub 2023 Dec 13. Microbiol Spectr. 2024. PMID: 38088543 Free PMC article.

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