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Prospective performance evaluation of selected common virtual screening tools. Case study: Cyclooxygenase (COX) 1 and 2

Computational methods can be applied in drug development for the identification of novel lead candidates, but also for the prediction of pharmacokinetic properties and potential adverse effects, thereby aiding to prioritize and identify the most promising compounds. In principle, several techniques...

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Detalhes bibliográficos
Publicado no:Eur J Med Chem
Main Authors: Kaserer, Teresa, Temml, Veronika, Kutil, Zsofia, Vanek, Tomas, Landa, Premysl, Schuster, Daniela
Formato: Artigo
Idioma:Inglês
Publicado em: Editions Scientifiques Elsevier 2015
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4444576/
https://ncbi.nlm.nih.gov/pubmed/25916906
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.ejmech.2015.04.017
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