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MOLECULAR BASIS OF PHARMACORRESISTANCE TO BENZIMIDAZOLS IN β-TUBULIN MUTANTS OF CYATHOSTOMINS
Dany Naranjo Feliciano
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COMPETENCIA TÉCNICA DE laboratorios para la detección de patógenos Y contaminantes en alimentos Y PRODUCTOS BIOTECNOLÓGICOS CON IMPACTO EN UNA SALUD
Arsenio Betancourt Bravo
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VALIDACIÓN DE MÉTODOS ANALÍTICOS PARA LA CUANTIFICACIÓN DE METABOLITOS EN LAS HOJAS DE MORERA (Morus alba L.).
Sirley González Laime
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Phytoplasmas affect solanaceous and fabaceous crops in Cuba: Current situation
Madelaine L. Quiñones
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Comportamiento del cultivo de maíz (Zea mays L.) inoculado con rizobios ante el déficit hídrico.
Omar E. Cartaya Rubio
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Uso de antioxidantes (Spirulina platensis) en dietas para cerdos en crecimiento ceba. Evaluación sensorial
Dunia Esther Vitón Cabrera
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ESTUDIO DE PRODUCTOS NATURALES PARA USO ETNOMÉDICO Y COMO FUENTE PARA LA INVESTIGACIÓN Y EL DESARROLLO DE MEDICAMENTOS PARA ANIMALES Y HUMANOS
Luz María Sanchez Perera
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CARACTERIZACION DE CEPAS CUBANAS DE BEAUVERIA (HYPOCREALES: CLAVICIPITACEAE) CON POTENCIAL PRODUCTIVO PARA EL CONTROL DE PLAGAS AGRICOLAS.
Yamilé Baró Robaina
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PRINCIPALES PROBLEMAS FITOSANITARIOS DEL CULTIVO CHILE HABANERO EN CUBA.
Julia Elena Almándoz Parrado
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DETECTION OF blaCTX-M-15, blaCTX-M-55 AND blaCMY-2 GENES HARBORING ESCHERICHIA COLI ISOLATED FROM FOOD-PRODUCING ANIMALS IN CUBA
Yanet Lopez Dorta
Evento IV Seminario Internacional de Sanidad Agropecuaria
starts on
8 de mayo de 2023, 8:00:00 -0400
PLATAFORMA INTEGRADA DE ACOPLAMIENTO MOLECULAR: TRES CASOS DE ESTUDIO Y SOLUCIONES A PARTIR DEL DISEÑO RACIONAL DE FÁRMACOS
8/5/23 8:00
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8/5/23 9:30
(-0400)
(1 hora 30 minutos)
Dany Naranjo Feliciano
Researcher
at Centro Nacional de Sanidad Agropecuaria
danynaranjofeliciano@gmail.com
The computer-aided drug design uses computational chemistry to discover, enhance or study drugs related to biologically active molecules. The PubChem-BioAssay database has the distinctive asset of tracking down compounds from experimental trials with a therapeutic target. Here we developed a molecular docking integrated and distributed platform (MODIP, Molecular Docking Integrated Platform) based on UNIX like operating systems / Apache / MySQL / Ruby / RoR / Bootstrap / Autodock Vina and NCBI Entrez Utilities and PUG SOAP web services. MODIP is able to screen in parallel chemotherapeutic receptors and its off-targets related proteins. This platform downloads the bioactive compounds to a local database, allowing users to manage results through a friendly and intuitive interface. You can configure data downloads related to a specific target and incorporate them into virtual screening results previously obtained. It also provides the ability to monitor the process through email notifications or snapshots. The relevant study cases are Fasciola hepatica cathepsins –new inhibitors prediction-, cyathostomes beta tubulin –benzimidazole resistance- and mammalian lung phospholipase A2IIA –animal model choice-. All results were in the range, according to the allowable energy criterion in Kcal/mol. The whole code for the platform is available at two public github repositories https://github.com/r-calero/modip or https://github.com/LMDM/modip. The system is a useful tool for the present and future trials for finding new prophylactic or therapeutic drugs, targeting the veterinarian branches.