Prediction of potential inhibitors of the dimeric SARS-CoV2 main proteinase through the MM/GBSA approach

por Bello, Martiniano
Publicado 2020

Molecular Basis of Inhibitory Mechanism of Naltrexone and Its Metabolites through Structural and Energetic Analyses

por Bello, Martiniano
Publicado 2022

Evaluating the ability of end-point methods to predict the binding affinity tendency of protein kinase inhibitors

por Bello, Martiniano, Bandala, Cindy
Publicado 2023

Microsecond MD Simulations to Explore the Structural and Energetic Differences between the Human RXRα-PPARγ vs. RXRα-PPARγ-DNA

por Azam, Faizul, Bello, Martiniano
Publicado 2022

Dynamic and thermodynamic impact of L94A, W100A, and W100L mutations on the D2 dopamine receptor bound to risperidone

por Azam, Faizul, Bello, Martiniano
Publicado 2022

Molecular Dynamics Simulations to Provide Insights into Epitopes Coupled to the Soluble and Membrane-Bound MHC-II Complexes

por Bello, Martiniano, Correa-Basurto, Jose
Publicado 2013

Energetic and structural basis for the differences in infectivity between the wild-type and mutant spike proteins of SARS-CoV-2 in the Mexican population

por Bello, Martiniano, Hasan, Md Kamrul, Hussain, Nazmul
Publicado 2021

Identification of saquinavir as a potent inhibitor of dimeric SARS-CoV2 main protease through MM/GBSA

por Bello, Martiniano, Martínez-Muñoz, Alberto, Balbuena-Rebolledo, Irving
Publicado 2020

Molecular Dynamics of a Thermostable Multicopper Oxidase from Thermus thermophilus HB27: Structural Differences between the Apo and Holo Forms

por Bello, Martiniano, Valderrama, Brenda, Serrano-Posada, Hugo, Rudiño-Piñera, Enrique
Publicado 2012

Repurposing FDA Drug Compounds against Breast Cancer by Targeting EGFR/HER2

por Balbuena-Rebolledo, Irving, Padilla-Martínez, Itzia Irene, Rosales-Hernández, Martha Cecilia, Bello, Martiniano
Publicado 2021

Structural insights into SARS-CoV-2 spike protein and its natural mutants found in Mexican population

por Sixto-López, Yudibeth, Correa-Basurto, José, Bello, Martiniano, Landeros-Rivera, Bruno, Garzón-Tiznado, Jose Antonio, Montaño, Sarita
Publicado 2021

Hydroxamic acid derivatives as HDAC1, HDAC6 and HDAC8 inhibitors with antiproliferative activity in cancer cell lines

por Sixto-López, Yudibeth, Gómez-Vidal, José Antonio, de Pedro, Nuria, Bello, Martiniano, Rosales-Hernández, Martha Cecilia, Correa-Basurto, José
Publicado 2020

Identification of peptide epitopes of the gp120 protein of HIV-1 capable of inducing cellular and humoral immunity

por García-Machorro, Jazmín, Gutiérrez-Sánchez, Mara, Rojas-Ortega, Diego Alexander, Bello, Martiniano, Andrade-Ochoa, Sergio, Díaz-Hernández, Sebastián, Correa-Basurto, José, Rojas-Hernández, Saúl
Publicado 2023

Structural analogues of existing anti-viral drugs inhibit SARS-CoV-2 RNA dependent RNA polymerase: A computational hierarchical investigation

por Hasan, Md. Kamrul, Kamruzzaman, Mohammad, Bin Manjur, Omar Hamza, Mahmud, Araf, Hussain, Nazmul, Alam Mondal, Muhammad Shafiul, Hosen, Md. Ismail, Bello, Martiniano, Rahman, Atiqur
Publicado 2021

In silico design and cell-based evaluation of two dual anti breast cancer compounds targeting Bcl-2 and GPER

por Morelos-Garnica, Loreley-A., Guzmán-Velázquez, Sonia, Padilla-Martínez, Itzia-I., García-Sánchez, José-R., Bello, Martiniano, Bakalara, Norbert, Méndez-Luna, David, Correa-Basurto, José
Publicado 2023

The small organic molecule C19 binds and strengthens the KRAS4b-PDEδ complex and inhibits growth of colorectal cancer cells in vitro and in vivo

por Cruz-Nova, Pedro, Schnoor, Michael, Correa-Basurto, José, Bello, Martiniano, Briseño-Diaz, Paola, Rojo-Domínguez, Arturo, Ortiz-Mendoza, Carlos M., Guerrero-Aguirre, Jorge, García-Vázquez, Francisco J., Hernández-Rivas, Rosaura, Thompson-Bonilla, María del Rocío, Vargas, Miguel
Publicado 2018

(131)I-C19 Iodide Radioisotope and Synthetic I-C19 Compounds as K-Ras4B–PDE6δ Inhibitors: A Novel Approach against Colorectal Cancer—Biological Characterization, Biokinetics and Do...

por Cruz-Nova, Pedro, Ocampo-García, Blanca, Carrión-Estrada, Dayan Andrea, Briseño-Diaz, Paola, Ferro-Flores, Guillermina, Jiménez-Mancilla, Nallely, Correa-Basurto, José, Bello, Martiniano, Vega-Loyo, Libia, Thompson-Bonilla, María del Rocío, Hernández-Rivas, Rosaura, Vargas, Miguel
Publicado 2022

Modifications on the Tetrahydroquinoline Scaffold Targeting a Phenylalanine Cluster on GPER as Antiproliferative Compounds against Renal, Liver and Pancreatic Cancer Cells

por Méndez-Luna, David, Morelos-Garnica, Loreley Araceli, García-Vázquez, Juan Benjamín, Bello, Martiniano, Padilla-Martínez, Itzia Irene, Fragoso-Vázquez, Manuel Jonathan, Dueñas González, Alfonso, De Pedro, Nuria, Gómez-Vidal, José Antonio, Mendoza-Figueroa, Humberto Lubriel, Correa-Basurto, José
Publicado 2021

KRas4B-PDE6δ complex stabilization by small molecules obtained by virtual screening affects Ras signaling in pancreatic cancer

por Casique-Aguirre, Diana, Briseño-Díaz, Paola, García-Gutiérrez, Ponciano, la Rosa, Claudia Haydée González-de, Quintero-Barceinas, Reyna Sara, Rojo-Domínguez, Arturo, Vergara, Irene, Medina, Luis Alberto, Correa-Basurto, José, Bello, Martiniano, Hernández-Rivas, Rosaura, del RocioThompson-Bonilla, María, Vargas, Miguel
Publicado 2018

Dihydropyrazole-Carbohydrazide Derivatives with Dual Activity as Antioxidant and Anti-Proliferative Drugs on Breast Cancer Targeting the HDAC6

por Balbuena-Rebolledo, Irving, Rivera-Antonio, Astrid M., Sixto-López, Yudibeth, Correa-Basurto, José, Rosales-Hernández, Martha C., Mendieta-Wejebe, Jessica Elena, Martínez-Martínez, Francisco J., Olivares-Corichi, Ivonne María, García-Sánchez, José Rubén, Guevara-Salazar, Juan Alberto, Bello, Martiniano, Padilla-Martínez, Itzia I.
Publicado 2022