Rodolpho C Braga

Pred‐hERG: A Novel web‐Accessible Computational Tool for Predicting Cardiac Toxicity

Alexander Tropsha, Denis Fourches, Eugene Muratov, 2015, Molecular informatics.

Tuning HERG out: antitarget QSAR models for drug development.

Alexander Tropsha, Denis Fourches, Eugene Muratov, 2014, Current topics in medicinal chemistry.

Virtual screening strategies in medicinal chemistry: the state of the art and current challenges.

Vinicius M Alves, Carolina H Andrade, Vinicius M. Alves, 2014, Current topics in medicinal chemistry.

Assessing the performance of 3D pharmacophore models in virtual screening: how good are they?

Carolina H Andrade, Rodolpho C Braga, C. Andrade, 2013, Current topics in medicinal chemistry.

QSAR-driven design, synthesis and discovery of potent chalcone derivatives with antitubercular activity.

Eugene Muratov, Carolina Horta Andrade, Rodolpho C Braga, 2017, European journal of medicinal chemistry.

Structure-based prediction and biosynthesis of the major mammalian metabolite of the cardioactive prototype LASSBio-294.

Carolina H Andrade, Rodolpho C Braga, Luciano M Lião, 2010, Bioorganic & medicinal chemistry letters.

Structural and chemical basis for enhanced affinity to a series of mycobacterial thymidine monophosphate kinase inhibitors: fragment-based QSAR and QM/MM docking studies

Carolina H Andrade, Rodolpho C Braga, Bruno J Neves, 2012, Journal of Molecular Modeling.

QSAR models of human data can enrich or replace LLNA testing for human skin sensitization.

Alexander Tropsha, Denis Fourches, Nicole Kleinstreuer, 2016, Green chemistry : an international journal and green chemistry resource : GC.

Discovery of new potential hits of Plasmodium falciparum enoyl-ACP reductase through ligand- and structure-based drug design approaches.

Carolina H Andrade, Rodolpho C Braga, Bruno J Neves, 2013, Bioorganic & medicinal chemistry letters.