Prediction of infinite dilution activity coefficients of chlorinated organic compounds in aqueous solution from quantum-chemical descriptors. - Eduardo J. Delgado; Joel B. Alderete (J. Comput. Chem., 2001)

On the Calculation of Henry's Law Constants of Chlorinated Benzenes in Water from Semiempirical Quantum Chemical Methods. - Eduardo J. Delgado; Joel B. Alderete (J. Chem. Inf. Comput. Sci., 2002)

Prediction of Henry's Law Constants of Triazine Derived Herbicides from Quantum Chemical Continuum Solvation Models. - Eduardo J. Delgado; Joel B. Alderete (J. Chem. Inf. Comput. Sci., 2003)

A Simple QSPR Model for Predicting Soil Sorption Coefficients of Polar and Nonpolar Organic Compounds from Molecular Formula. - Eduardo J. Delgado; Joel B. Alderete; Gonzalo A. Jaña (J. Chem. Inf. Comput. Sci., 2003)

Quantum-connectivity descriptors in modeling solubility of environmentally important organic compounds. - Ernesto Estrada; Eduardo J. Delgado; Joel B. Alderete; Gonzalo A. Jaña (J. Comput. Chem., 2004)

On the Aggregation State and QSPR Models. The Solubility of Herbicides as a Case Study. - Eduardo J. Delgado; Joel B. Alderete; Adelio R. Matamala; Gonzalo A. Jaña (J. Chem. Inf. Model., 2004)

Structural insight into the role of Gln293Met mutation on the Peloruside A/Laulimalide association with αβ-tubulin from molecular dynamics simulations, binding free energy calculations and weak interactions analysis. - Matías A. Zúñiga; Joel B. Alderete; Gonzalo A. Jaña; Verónica A. Jiménez (J. Comput. Aided Mol. Des., 2017)

In Silico Design of Novel Mutant Anti-MUC1 Aptamers for Targeted Cancer Therapy. - Brianda L. Santini; Matías Zúñiga-Bustos; Abraham Vidal-Limon; Joel B. Alderete; Sergio A. Aguila; Verónica A. Jiménez (J. Chem. Inf. Model., 2020)

Mechanism-Based Rational Discovery and In Vitro Evaluation of Novel Microtubule Stabilizing Agents with Non-Taxol-Competitive Activity. - Matías A. Zúñiga; Pilar A. Vásquez; Gonzalo A. Jaña; José L. Guzmán; Joel B. Alderete; Verónica A. Jiménez (J. Chem. Inf. Model., 2020)

NanoMIPs Design for Fucose and Mannose Recognition: A Molecular Dynamics Approach. - Yadiris García; Brandon A. Úsuga; Cristian H. Campos; Joel B. Alderete; Verónica A. Jiménez (J. Chem. Inf. Model., 2021)

Rational Design of Novel Glycomimetic Peptides for E-Selectin Targeting. - Verónica A. Jiménez; Karen R. Navarrete; Mario Duque-Noreña; Kelly P. Marrugo; María A. Contreras; Cristian H. Campos; Joel B. Alderete (J. Chem. Inf. Model., 2021)