| Inhibition of cyclin-dependent kinases by purine analogues: crystal structure of human cdk2 complexed with roscovitine. W Filgueira de Azevedo Jr., S Leclerc, L Meijer, L Havlicek, M Strnad, ... European Journal of Biochemistry 243 (1-2), 518-26, 1997 | 946 | 1997 |
| Halogen atoms in the modern medicinal chemistry: hints for the drug design MZ Hernandes, SMT Cavalcanti, DRM Moreira, ... Current Drug Targets 11 (3), 303-314, 2010 | 793 | 2010 |
| Structural basis for specificity and potency of a flavonoid inhibitor of human CDK2, a cell cycle kinase W Filgueira de Azevedo Jr., HJ Mueller-Dieckmann, U Schulze-Gahmen, ... Proceedings of the National Academy of Sciences 93 (7), 2735-2740, 1996 | 643 | 1996 |
| Molecular docking algorithms R Dias, W Filgueira de Azevedo Jr. Current Drug Targets 9 (12), 1040-1047, 2008 | 417 | 2008 |
| Molegro Virtual Docker for Docking G Bitencourt-Ferreira, W Filgueira de Azevedo Jr. Docking Screens for Drug Discovery, 149-167, 2019 | 368 | 2019 |
| 4-Arylazo-3, 5-diamino-1 H-pyrazole CDK inhibitors: SAR study, crystal structure in complex with CDK2, selectivity, and cellular effects V Kryštof, P Cankař, I Fryšová, J Slouka, G Kontopidis, P Džubák, ... Journal of Medicinal Chemistry 49 (22), 6500-6509, 2006 | 251 | 2006 |
| Anoplin, a novel antimicrobial peptide from the venom of the solitary wasp Anoplius samariensis K Konno, M Hisada, R Fontana, CCB Lorenzi, H Naoki, Y Itagaki, A Miwa, ... Biochimica et Biophysica Acta (BBA)-Protein Structure and Molecular …, 2001 | 197 | 2001 |
| Structural basis for inhibition of cyclin-dependent kinase 9 by flavopiridol W Filgueira de Azevedo Jr., F Canduri, NJF da Silveira Biochemical and Biophysical Research Communications 293 (1), 566-571, 2002 | 181 | 2002 |
| Docking with AutoDock4 G Bitencourt-Ferreira, VO Pintro, W Filgueira de Azevedo Jr. Docking Screens for Drug Discovery, 125-148, 2019 | 180 | 2019 |
| MolDock applied to structure-based virtual screening W Filgueira de Azevedo Jr. Current Drug Targets 11 (3), 327-334, 2010 | 154 | 2010 |
| The use of biodiversity as source of new chemical entities against defined molecular targets for treatment of malaria, tuberculosis, and T-cell mediated diseases: a review LA Basso, LHP Silva, AG Fett-Neto, W Filgueira de Azevedo Jr., ... Memórias do Instituto Oswaldo Cruz 100 (6), 475-506, 2005 | 150 | 2005 |
| Antimalarial activity of physalins B, D, F, and G MS Sá, MN de Menezes, AU Krettli, IM Ribeiro, TCB Tomassini, ... Journal of Natural Products 74 (10), 2269-2272, 2011 | 142 | 2011 |
| SAnDReS a Computational Tool for Statistical Analysis of Docking Results and Development of Scoring Functions. M Morrone Xavier, G Sehnem Heck, M Boff de Avila, NM Bernhardt Levin, ... Comb Chem High Throughput Screen. 19 (10), 1-12, 2016 | 138 | 2016 |
| Docking screens for drug discovery WF De Azevedo Jr Humana Press, 2019 | 135 | 2019 |
| Automated NMR structure determination and disulfide bond identification of the myotoxin crotamine from Crotalus durissus terrificus V Fadel, P Bettendorff, T Herrmann, W Filgueira de Azevedo Jr., ... Toxicon 46 (7), 759-767, 2005 | 131 | 2005 |
| Hydrogen Bonds in Protein-Ligand Complexes G Bitencourt-Ferreira, M Veit-Acosta, W Filgueira de Azevedo Jr. Docking Screens for Drug Discovery, 93-107, 2019 | 126 | 2019 |
| Docking with SwissDock G Bitencourt-Ferreira, W Filgueira de Azevedo Jr. Docking Screens for Drug Discovery, 189-202, 2019 | 125 | 2019 |
| Crystallographic and spectroscopic characterization of a molecular hinge: Conformational changes in bothropstoxin I, a dimeric Lys49‐phospholipase A2 homologue MT da Silva Giotto, RC Garratt, G Oliva, YP Mascarenhas, JR Giglio, ... Proteins: Structure, Function, and Bioinformatics 30 (4), 442-454, 1998 | 125 | 1998 |
| Computational methods for calculation of ligand-binding affinity W Filgueira de Azevedo Jr., R Dias Current drug targets 9 (12), 1031-1039, 2008 | 124 | 2008 |
| Bio-inspired algorithms applied to molecular docking simulations G Heberlé, W Filgueira de Azevedo Jr. Current medicinal chemistry 18 (9), 1339-1352, 2011 | 122 | 2011 |
Jose Henrique PereiraLawrence Berkeley National LaboratoryVerified email at lbl.gov
