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Lista de obras de Rodolpho C. Braga

3D-QSAR approaches in drug design: perspectives to generate reliable CoMFA models

artículo científico

Advances in methods for predicting phase I metabolism of polyphenols

artículo científico

Alarms about structural alerts

artículo científico publicado en 2016

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

artículo científico

Catalytic Applications of Chiral Organoselenium Compounds in Asymmetric Synthesis

Combination of docking, molecular dynamics and quantum mechanical calculations for metabolism prediction of 3,4-methylenedioxybenzoyl-2-thienylhydrazone

article

Deep Learning-driven research for drug discovery: Tackling Malaria

scientific article published on 18 February 2020

Design, synthesis, biological evaluation and X-ray structural studies of potent human dihydroorotate dehydrogenase inhibitors based on hydroxylated azole scaffolds.

artículo científico publicado en 2017

Determination of the cardioactive prototype LASSBio-294 and its metabolites in dog plasma by LC–MS/MS: Application for a pharmacokinetic study

artículo científico publicado en 2011

Development of topotecan loaded lipid nanoparticles for chemical stabilization and prolonged release.

artículo científico publicado en 2011

Dihydropyrimidin-(2H)-ones obtained by ultrasound irradiation: a new class of potential antioxidant agents.

artículo científico publicado en 2006

Discovery of New Anti-Schistosomal Hits by Integration of QSAR-Based Virtual Screening and High Content Screening

artículo científico publicado en 2016

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

artículo científico publicado en 2013

Déjà vu: Stimulating open drug discovery for SARS-CoV-2

scientific article published on 19 April 2020

Efficient synthesis of chiral beta-seleno amides via ring-opening reaction of 2-oxazolines and their application in the palladium-catalyzed asymmetric allylic alkylation

artículo científico publicado en 2005

Evaluation of cytotoxic effect of the combination of a pyridinyl carboxamide derivative and oxaliplatin on NCI-H1299 human non-small cell lung carcinoma cells

artículo científico publicado en 2016

In silico repositioning-chemogenomics strategy identifies new drugs with potential activity against multiple life stages of Schistosoma mansoni

artículo científico publicado en 2015

Microbial β-glycosylation of entacapone by Cunninghamella echinulata ATCC 9245

artículo científico publicado en 2012

Pred-Skin: A Fast and Reliable Web Application to Assess Skin Sensitization Effect of Chemicals.

artículo científico publicado en 2017

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

artículo científico publicado en 2015

QSAR and QM/MM Approaches Applied to Drug Metabolism Prediction ⬇️

artículo científico publicado el 1 de junio de 2012

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

artículo científico publicado en 2016

QSAR-Driven Discovery of Novel Chemical Scaffolds Active against Schistosoma mansoni

scientific article published on 02 June 2016

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

artículo científico publicado en 2012

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

artículo científico publicado en 2010

The A-Z of Zika drug discovery

artículo científico publicado en 2018

Tuning HERG out: antitarget QSAR models for drug development

artículo científico publicado en 2014

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