3D Connectivity Indices in QSPR/QSAR Studies. - Ernesto Estrada; Enrique Molina Pérez (J. Chem. Inf. Comput. Sci., 2001)

Can 3D Structural Parameters Be Predicted from 2D (Topological) Molecular Descriptors? - Ernesto Estrada; Enrique Molina Pérez; Iliana Perdomo-López (J. Chem. Inf. Comput. Sci., 2001)

Designing Antibacterial Compounds through a Topological Substructural Approach. - Enrique Molina Pérez; Humberto González Díaz; Maykel Pérez González; Elismary Rodríguez; Eugenio Uriarte (J. Chem. Inf. Model., 2004)

An Integrated in Silico Analysis of Drug-Binding to Human Serum Albumin. - Ernesto Estrada; Eugenio Uriarte; Enrique Molina Pérez; Yamil Simón-Manso; George W. A. Milne (J. Chem. Inf. Model., 2006)

Designing novel antitrypanosomal agents from a mixed graph-theoretical substructural approach. - Alejandro Speck Planche; Marcus Tulius Scotti; Vicente de Paulo Emerenciano; América García López; Enrique Molina Pérez; Eugenio Uriarte (J. Comput. Chem., 2010)