QSAR-based virtual screening: advances and applications in drug discovery BJ Neves, RC Braga, CC Melo-Filho, JT Moreira-Filho, EN Muratov, ... Frontiers in pharmacology 9, 1275, 2018 | 409 | 2018 |
Dihydropyrimidin-(2H)-ones obtained by ultrasound irradiation: a new class of potential antioxidant agents HA Stefani, CB Oliveira, RB Almeida, CMP Pereira, RC Braga, R Cella, ... European journal of medicinal chemistry 41 (4), 513-518, 2006 | 219 | 2006 |
Pred‐hERG: A novel web‐accessible computational tool for predicting cardiac toxicity RC Braga, VM Alves, MFB Silva, E Muratov, D Fourches, LM Lião, ... Molecular informatics 34 (10), 698-701, 2015 | 177 | 2015 |
Development of topotecan loaded lipid nanoparticles for chemical stabilization and prolonged release LG Souza, EJ Silva, ALL Martins, MF Mota, RC Braga, EM Lima, ... European journal of pharmaceutics and biopharmaceutics 79 (1), 189-196, 2011 | 170 | 2011 |
Assessing the performance of 3D pharmacophore models in virtual screening: how good are they? RC Braga, CH Andrade Current topics in medicinal chemistry 13 (9), 1127-1138, 2013 | 135 | 2013 |
Alarms about structural alerts VM Alves, EN Muratov, SJ Capuzzi, R Politi, Y Low, RC Braga, ... Green Chemistry 18 (16), 4348-4360, 2016 | 133 | 2016 |
Efficient synthesis of chiral β-seleno amides via ring-opening reaction of 2-oxazolines and their application in the palladium-catalyzed asymmetric allylic alkylation AL Braga, F Vargas, JA Sehnem, RC Braga The Journal of Organic Chemistry 70 (22), 9021-9024, 2005 | 127 | 2005 |
QSAR-driven design, synthesis and discovery of potent chalcone derivatives with antitubercular activity MN Gomes, RC Braga, EM Grzelak, BJ Neves, E Muratov, R Ma, LL Klein, ... European journal of medicinal chemistry 137, 126-138, 2017 | 119 | 2017 |
Tuning HERG out: antitarget QSAR models for drug development R C Braga, V M Alves, M FB Silva, E Muratov, D Fourches, A Tropsha, ... Current topics in medicinal chemistry 14 (11), 1399-1415, 2014 | 116 | 2014 |
Catalytic applications of chiral organoselenium compounds in asymmetric synthesis AL Braga, DS Luedtke, F Vargas, RC Braga Synlett 2006 (10), 1453-1466, 2006 | 115 | 2006 |
A mild and efficient method for halogenation of 3, 5-dimethyl pyrazoles by ultrasound irradiation using N-halosuccinimides HA Stefani, CMP Pereira, RB Almeida, RC Braga, KP Guzen, R Cella Tetrahedron letters 46 (40), 6833-6837, 2005 | 111 | 2005 |
Déjà vu: stimulating open drug discovery for SARS-CoV-2 S Ekins, M Mottin, PRPS Ramos, BKP Sousa, BJ Neves, DH Foil, KM Zorn, ... Drug discovery today 25 (5), 928-941, 2020 | 110 | 2020 |
Pred-skin: a fast and reliable web application to assess skin sensitization effect of chemicals RC Braga, VM Alves, EN Muratov, J Strickland, N Kleinstreuer, ... Journal of chemical information and modeling 57 (5), 1013-1017, 2017 | 80 | 2017 |
Discovery of new anti-schistosomal hits by integration of QSAR-based virtual screening and high content screening BJ Neves, RF Dantas, MR Senger, CC Melo-Filho, WCG Valente, ... Journal of medicinal chemistry 59 (15), 7075-7088, 2016 | 78 | 2016 |
3D-QSAR approaches in drug design: perspectives to generate reliable CoMFA models. CC Melo-Filho, RC Braga, CH Andrade Current computer-aided drug design 10 (2), 148-159, 2014 | 74 | 2014 |
Virtual screening strategies in medicinal chemistry: the state of the art and current challenges R C Braga, V M Alves, A C Silva, M N Nascimento, F C Silva, L M Liao, ... Current topics in medicinal chemistry 14 (16), 1899-1912, 2014 | 71 | 2014 |
The A–Z of Zika drug discovery M Mottin, JVVB Borba, RC Braga, PHM Torres, MC Martini, ... Drug discovery today 23 (11), 1833-1847, 2018 | 61 | 2018 |
Design, synthesis, biological evaluation and X-ray structural studies of potent human dihydroorotate dehydrogenase inhibitors based on hydroxylated azole scaffolds S Sainas, AC Pippione, M Giorgis, E Lupino, P Goyal, C Ramondetti, ... European Journal of Medicinal Chemistry 129, 287-302, 2017 | 61 | 2017 |
In Silico Repositioning-Chemogenomics Strategy Identifies New Drugs with Potential Activity against Multiple Life Stages of Schistosoma mansoni BJ Neves, RC Braga, JCB Bezerra, PVL Cravo, CH Andrade PLoS Neglected Tropical Diseases 9 (1), e3435, 2015 | 60 | 2015 |
STopTox: An in Silico Alternative to Animal Testing for Acute Systemic and Topical Toxicity JVB Borba, VM Alves, RC Braga, DR Korn, K Overdahl, AC Silva, ... Environmental Health Perspectives 130 (2), 027012, 2022 | 58 | 2022 |