About the Authors

Bruno J. Neves

Roles Conceptualization, Data curation, Formal analysis, Investigation, Methodology, Visualization, Writing – original draft, Writing – review & editing

Affiliations Laboratory of Cheminformatics, University Center of Anápolis – UniEVANGÉLICA, Anápolis, Goiás, Brazil, LabMol – Laboratory for Molecular Modeling and Drug Design, Faculty of Pharmacy, Federal University of Goiás, Goiânia, Goiás, Brazil

Rodolpho C. Braga

Roles Conceptualization, Data curation, Formal analysis, Methodology, Software, Writing – original draft, Writing – review & editing

Affiliation InsilicAll, São Paulo, São Paulo, Brazil

Vinicius M. Alves

Roles Data curation, Methodology, Visualization, Writing – original draft

Affiliations LabMol – Laboratory for Molecular Modeling and Drug Design, Faculty of Pharmacy, Federal University of Goiás, Goiânia, Goiás, Brazil, Laboratory for Molecular Modeling, UNC Eshelman School of Pharmacy, University of North Carolina, Chapel Hill, North Carolina, United States of America

Marília N. N. Lima

Roles Data curation, Validation, Visualization, Writing – review & editing

Affiliation LabMol – Laboratory for Molecular Modeling and Drug Design, Faculty of Pharmacy, Federal University of Goiás, Goiânia, Goiás, Brazil

Gustavo C. Cassiano

Roles Methodology, Validation, Writing – original draft, Writing – review & editing

Affiliations Laboratory of Tropical Diseases–Prof. Dr. Luiz Jacintho da Silva, Department of Genetics, Evolution, Microbiology and Immunology, Institute of Biology, University of Campinas, Campinas, São Paulo, Brazil, Global Health and Tropical Medicine (GHTM), Instituto de Higiene e Medicina Tropical (IHMT), Universidade Nova de Lisboa (UNL), Lisboa, Portugal

Eugene N. Muratov

Roles Conceptualization, Software, Supervision, Writing – original draft, Writing – review & editing

Affiliations Laboratory for Molecular Modeling, UNC Eshelman School of Pharmacy, University of North Carolina, Chapel Hill, North Carolina, United States of America, Department of Chemical Technology, Odessa National Polytechnic University, Odessa, Ukraine

Fabio T. M. Costa

Roles Funding acquisition, Resources, Supervision, Validation, Writing – review & editing

Affiliation Laboratory of Tropical Diseases–Prof. Dr. Luiz Jacintho da Silva, Department of Genetics, Evolution, Microbiology and Immunology, Institute of Biology, University of Campinas, Campinas, São Paulo, Brazil

Carolina Horta Andrade

Roles Conceptualization, Funding acquisition, Investigation, Project administration, Resources, Supervision, Writing – original draft, Writing – review & editing

carolina@ufg.br

Affiliations LabMol – Laboratory for Molecular Modeling and Drug Design, Faculty of Pharmacy, Federal University of Goiás, Goiânia, Goiás, Brazil, Laboratory of Tropical Diseases–Prof. Dr. Luiz Jacintho da Silva, Department of Genetics, Evolution, Microbiology and Immunology, Institute of Biology, University of Campinas, Campinas, São Paulo, Brazil

Competing Interests

I have read the journal's policy and the authors of this manuscript have the following competing interests: RCB is CTO of InsilicAll, Inc. All other authors have declared that no competing interests exist.