Grammatical evolution-based design of SARS-CoV-2 main protease inhibitors

Author:

Frausto-Parada Francisco1,Várgas-Rodríguez Ismael1,Mercado-Sánchez Itzel1,Bazán-Jiménez Adán1,Díaz-Cervantes Erik2ORCID,Sotelo-Figueroa Marco A.3,García-Revilla Marco A.1ORCID

Affiliation:

1. Department of Chemistry, Natural and Exact Sciences Division, University of Guanajuato, Noria Alta S/N, Guanajuato-36050, Mexico

2. Departamento de Alimentos, Centro Interdisciplinario del Noreste de la Universidad de Guanajuato, Tierra Blanca, Guanajuato-37975, Mexico

3. 3Department of Organizational Studies, Economical and Administrative Sciences Division, University of Guanajuato, Guanajuato-36000, Mexico

Abstract

A series of SARS-CoV-2 main protease (SARS-CoV-2-Mpro) inhibitors were modeled using evolutive grammar algorithms.

Funder

Consejo Nacional de Ciencia y Tecnología

Universidad de Guanajuato

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

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