Ab initio conformational analysis of cyclooctane molecule. - Willian R. Rocha; Josefredo R. Pliego Jr.; Stella M. Resende; Hélio F. Dos Santos; Marcos A. De Oliveira; Wagner B. De Almeida (J. Comput. Chem., 1998)

Performance of the SMD and SM8 models for predicting solvation free energy of neutral solutes in methanol, dimethyl sulfoxide and acetonitrile. - Caroline C. Zanith; Josefredo R. Pliego Jr. (J. Comput. Aided Mol. Des., 2015)

Theoretical design of new ligands to boost reaction rate and selectivity in palladium-catalyzed aromatic fluorination. - Josefredo R. Pliego Jr. (J. Comput. Chem., 2025)