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A THEORETICAL STRUCTURE-AFFINITY RELATIONSHIP STUDY OF SOME CANNABINOID DERIVATIVES
(Sociedad Chilena de Química, 2008)
Estudos de QSAR de furanobenzoamidinas frente à Pneumocystis carinii, Candida albicans e Cryptococcus neofarmans.: síntese de análogos furânicos S-isotioureidos
(Universidade Federal de Minas GeraisUFMG, 2011-12-05)
This work presents the results obtained in the studies of docking and QSAR carried out with a group of bis cationic bisamidines against Candida albicans, Cryptococcus neofarmans andPneumocystis carinii. As well as synthesis, ...
Síntese e desenvolvimento de um modelo de QSAR para derivados do (-)-borneol contra larvas de Aedes aegypti
(Universidade Federal de SergipePós-Graduação em Ciências FarmacêuticasBrasilUFS, 2017)
2D QSAR studies on thyroid hormone receptor ligands
(2007)
2D QSAR studies were carried out for a series of 55 ligands for the Thyroid receptors, TRα and TRβ. Significant cross-validated correlation coefficients (q2 = 0.781 (TRα) and 0.693 (TRβ)) were obtained. The models’ predictive ...
Pharmacokinetic properties and in silico ADME modeling in drug discovery
(Bentham ScienceBussum, 2013-03)
The discovery and development of a new drug are time-consuming, difficult and expensive. This complex process has evolved from classical methods into an integration of modern technologies and innovative strategies addressed ...
QSAR and molecular graphics analysis of N-2-phenylguanines as inhibitors of herpes simplex virus thymidine kinases
(Elsevier Science IncNew YorkEUA, 2000)