University of Sao Paulo (USP), Physics Institute of Sao Carlos, Laboratory of Medicinal and Computational Chemistry, Universidade Estadual de Campinas (UNICAMP) - Institute of Chemistry, Federal University of Minas Gerais (UFMG) - Department of Biochemistry and Immunology, Universidade Estadual de Campinas (UNICAMP) - Institute of Chemistry, University of Sao Paulo (USP), Physics Institute of Sao Carlos, Laboratory of Medicinal and Computational Chemistry, University of Sao Paulo (USP), Physics Institute of Sao Carlos, Laboratory of Medicinal and Computational Chemistry, University of Sao Paulo (USP), Physics Institute of Sao Carlos, Laboratory of Medicinal and Computational Chemistry, University of Sao Paulo (USP), Physics Institute of Sao Carlos, Laboratory of Medicinal and Computational Chemistry, University of Sao Paulo (USP), Physics Institute of Sao Carlos, Laboratory of Medicinal and Computational Chemistry, Federal University of São Paulo (UNIFESP) - Department of Pharmacology, Universidade Estadual de Campinas (UNICAMP) - Institute of Chemistry and University of Sao Paulo (USP), Physics Institute of Sao Carlos, Laboratory of Medicinal and Computational Chemistry