PK/DB: database for pharmacokinetic properties and predictive in silico ADME models. - Tiago L. Moda; Leonardo G. Torres; Alexandre E. Carrara; Adriano D. Andricopulo (Bioinform., 2008)

Structural Basis for Selective Inhibition of Trypanosomatid Glyceraldehyde-3-Phosphate Dehydrogenase: Molecular Docking and 3D QSAR Studies. - Rafael V. C. Guido; Glaucius Oliva; Carlos Alberto Montanari; Adriano D. Andricopulo (J. Chem. Inf. Model., 2008)

Structure-Based Approach for the Study of Estrogen Receptor Binding Affinity and Subtype Selectivity. - Lívia Barros Salum; Igor Polikarpov; Adriano D. Andricopulo (J. Chem. Inf. Model., 2008)

Role of Halogen Bonds in Thyroid Hormone Receptor Selectivity: Pharmacophore-Based 3D-QSSR Studies. - Napoleão Fonseca Valadares; Lívia Barros Salum; Igor Polikarpov; Adriano D. Andricopulo; Richard Garratt (J. Chem. Inf. Model., 2009)

Discovery of New Inhibitors of Schistosoma mansoni PNP by Pharmacophore-Based Virtual Screening. - Matheus P. Postigo; Rafael V. C. Guido; Glaucius Oliva; Marcelo Santos Castilho; Ivan da R. Pitta; Julianna F. C. de Albuquerque; Adriano D. Andricopulo (J. Chem. Inf. Model., 2010)

Discovery of New Inhibitors of Mycobacterium tuberculosis InhA Enzyme Using Virtual Screening and a 3D-Pharmacophore-Based Approach. - Ivani Pauli; Ricardo N. dos Santos; Diana C. Rostirolla; Leonardo K. Martinelli; Rodrigo G. Ducati; Luís Fernando S. M. Timmers; Luiz Augusto Basso; Diógenes Santiago Santos; Rafael V. C. Guido; Adriano D. Andricopulo; Osmar Norberto de Souza (J. Chem. Inf. Model., 2013)

Development of a pharmacophore for cruzain using oxadiazoles as virtual molecular probes: quantitative structure-activity relationship studies. - Anacleto Silva de Souza; Marcelo T. de Oliveira; Adriano D. Andricopulo (J. Comput. Aided Mol. Des., 2017)

Chemical Space and Diversity of the NuBBE Database: A Chemoinformatic Characterization. - Fernanda I. Saldívar-González; Marilia Valli; Adriano D. Andricopulo; Vanderlan da Silva Bolzani; José L. Medina-Franco (J. Chem. Inf. Model., 2019)

Discovery of Potent, Reversible, and Competitive Cruzain Inhibitors with Trypanocidal Activity: A Structure-Based Drug Design Approach. - Mariana Laureano de Souza; Celso de Oliveira Rezende Junior; Rafaela Salgado Ferreira; Rocio Marisol Espinoza Chávez; Leonardo L. G. Ferreira; Brian W. Slafer; Luma G. Magalhães; Renata Krogh; Glaucius Oliva; Fabio Cardoso Cruz; Luiz Carlos Dias; Adriano D. Andricopulo (J. Chem. Inf. Model., 2020)

Latin American Natural Product Database (LANaPDB): An Update. - Alejandro Gómez-García; Daniel A Acuña Jiménez; William J. Zamora; Haruna L. Barazorda-Ccahuana; Miguel Á. Chávez-Fumagalli; Marilia Valli; Adriano D. Andricopulo; Vanderlan da S. Bolzani; Dionisio A Olmedo; Pablo N. Solís; Marvin J. Núñez; Johny R. Rodríguez Pérez; et al. (J. Chem. Inf. Model., 2024)