selected publications
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academic article
- 1-aryl-3-[4-(thieno[3,2-d]pyrimidin-4-yloxy)phenyl]ureas as VEGFR-2 tyrosine kinase inhibitors: Synthesis, biological evaluation, and molecular modelling studies. BioMed Research International. 2013. 2013
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conference paper
- Inhibition of the VEGFR-2 tyrosine kinase domain by witd Roman chamomile extracts and phenolic compounds 2015
- VScore: a software for management of large scale virtual screening projects in computer clusters 2015
- Aplicação de ferramentas de quimioinformática no desenvolvimento de novos fármacos: tienopiridinas como inibidores de VEGFR-2 2013
- Synthesis of new N-[3-(thieno[3,2-b]pyridine-7-ylthio)phenyl]benzamides as potential inhibitors of VEGFR2 using rational design 2013
- Synthesis of new N-[3-(thieno[3,2-b]pyridine-7-ylthio)phenyl]benzamides as potential inhibitors the tyrosine kinase domain of VEGFR2 2013
- VScore: uma plataforma para desenvolvimento de novos fármacos usando screening virtual 2013
- 1-Aryl-3-[ 4-( thieno[3,2-d]pyrimidin-4-yloxy )phenyl]ureas as VEG FR2 inhibitors: synthesis, docking enzymatic and cellular assays 2012
- 1-Aryl-3-[4-(thieno[3,2-d]pyrimidin-4-yloxy)phenyl]ureas as VEGFR2 tyrosine kinase inhibitors: synthesis, docking studies, enzymatic and cellular assays 2012
- Docking studies to evaluate mushrooms low molecular weight compounds as inhibitors of the anti-apoptotic protein BCL-2. 1247. 2012
- Heteroarylether 1,3-diarylureas in the thieno[3,2-d]pyrimidine series as VEGFR2 tyrosine Kinase inhibitors: synthesis, docking studies, enzymatic and cellular assays 2012
- Screening virtual e dinâmica molecular de compostos presentes em cogumelos com potencial inibidor de BCL2 2012
- Synthesis of novel 1-aryl-3-[2,3- or 4-(thieno[3,2-b]pyridin-7-ylthio)phenyl]ureas and evaluation as VEGFR2 tyrosine kinase inhibitors 2012
- Synthesis, docking, enzymatic and cellular assays of thieno[3,2-b]pyridine-thioether-1,3-diarylureas as VEGFR2 inhibitors 2012
- 1-Aryl-3-[4-(thieno[3,2-d]pyrimidin-4-yloxy)phenyl]ureas as potential inhibitors of VEGFR-2: synthesis and molecular modelling studies 2011
- 1-aryl-3-(4-(7-methylthieno[3,2-d]pyrimidin-4-yloxy)phenyl)ureas: synthesis and molecular modelling studies using VEGFR-2 2011
- Desenvolvimento de ferramentas de bioinformática para aplicação em Química Medicinal: MOLA e ChemT. 2011
- Mdm2 as a potential target for mushrooms LMW compounds. 2011
- Methyl 3-[4-(3-arylureido)phenylamino]thieno[3,2-b]pyridine-2-carboxylates as potential inhibitors of VEGFR-2: synthesis and molecular modelling studies 2011
- Methyl 3-amino-6-[4 or 3 or 2-(3-arylureido)phenyl]thieno[3,2-b]pyridine-2-carboxylates: synthesis and molecular modelling studies using VEGFR-2 2011
- Rational design of thieno[3,2-b]pyridines as potential new VEGFR-2 inhibitors based on improved docking scores. 2011
- VEGFR2 selective residue flexibility enriches AutoDock Vina docking results 2011
- Valorização de cogumelos silvestres como alimentos funcionais: estudos de química computacional 2011
- ChemT, a software for building template-based 3D chemical libraries. 2010
- Docking studies using proteins involved in breast cancer and low molecular weight compounds found in wild mushrooms 2010
- Virtual ligand screening studies between mushroom compounds and proteins involved in breast cancer 2010
- MOLA: a tool for automation of parallel virtual docking using AutoDock Vina in a heterogeneous set of computer clusters 2009
- Nova metodologia computacional de “Docking” proteína-ligando utilizando o AutoDock4 2009
- A convenient high performance computing (HPC) methodology for virtual screening using Autodock 4 2008
- Farnesoid X receptor: docking model validation 2008
- O potencial antioxidante dos fitoquímicos 2008
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document
- Inhibition of the VEGFR-2 tyrosine kinase domain by witd Roman chamomile extracts and phenolic compounds 2015
- Synthesis of new N-[3-(thieno[3,2-b]pyridine-7-ylthio)phenyl]benzamides as potential inhibitors the tyrosine kinase domain of VEGFR2 2013
- Docking studies to evaluate the potential capacity of mushrooms low molecular weight compounds as inhibitors of the anti-apoptotic protein Bcl-2. 1247-1247. 2012
- 1-Aryl-3-[4-(thieno[3,2-d]pyrimidin-4-yloxy)phenyl]ureas as VEGFR2 tyrosine kinase inhibitors: synthesis, docking studies, enzymatic and cellular assays 2012
- Heteroarylether 1,3-diarylureas in the thieno[3,2-d]pyrimidine series as VEGFR2 tyrosine Kinase inhibitors: synthesis, docking studies, enzymatic and cellular assays 2012
- Screening virtual e dinâmica molecular de compostos presentes em cogumelos com potencial inibidor de BCL2 2012
- Mdm2 as a potential target for mushrooms LMW compounds. 2011
- Methyl 3-[4-(3-arylureido)phenylamino]thieno[3,2-b]pyridine-2-carboxylates as potential inhibitors of VEGFR-2: synthesis and molecular modelling studies 2011
- Rational design of thieno[3,2-b]pyridines as potential new VEGFR-2 inhibitors based on improved docking scores. 2011
- A QCAR model for predicting antioxidant activity of wild mushrooms 2009
- O potencial antioxidante dos fitoquímicos 2008
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journal article
- Wild Roman chamomile extracts and phenolic compounds: Enzymatic assays and molecular modelling studies with VEGFR-2 tyrosine kinase. Food & Function. 79-83. 2016
- Synthesis, antiangiogenesis evaluation and molecular docking studies of 1-aryl-3-[(thieno[3,2-b]pyridin-7-ylthio)phenyl]ureas: Discovery of a new substitution pattern for type II VEGFR-2 Tyr kinase inhibitors. Bioorganic & Medicinal Chemistry. 6497-6509. 2015
- Docking Studies in Target Proteins Involved in Antibacterial Action Mechanisms: Extending the Knowledge on Standard Antibiotics to Antimicrobial Mushroom Compounds. Molecules. 1672-1684. 2014
- Antimicrobial activity of phenolic compounds identified in wild mushrooms, SAR analysis and docking studies. Journal of Applied Microbiology. 346-357. 2013
- 1-Aryl-3-[4-(thieno[3,2-d]pyrimidin-4-yloxy)phenyl]ureas as VEGFR-2 tyrosine kinase inhibitors: Synthesis, biological evaluation, and molecular modelling studies. BioMed Research International. 1-9. 2013
- Virtual screening of low molecular weight mushrooms compounds as potential Mdm2 inhibitors. Journal of Enzyme Inhibition and Medicinal Chemistry. 569-575. 2013
- Selective Flexibility of Side-Chain Residues Improves VEGFR-2 Docking Score using AutoDock Vina. Chemical Biology and Drug Design. 530-534. 2012
- QCAR models to predict wild mushrooms radical scavenging activity, reducing power and lipid peroxidation inhibition. Chemometrics and Intelligent Laboratory Systems. 192-196. 2011
- Using molecular docking to investigate the anti-breast cancer activity of low molecular weight compounds present on wild mushrooms. SAR and QSAR in Environmental Research. 315-328. 2011
- MOLA: A bootable, self-configuring system for virtual screening using AutoDock4/Vina on computer clusters. Journal of Cheminformatics. 10. 2010
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thesis