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Discovery of Novel MDR-Mycobacterium tuberculosis Inhibitor by New FRIGATE Computational Screen

With 1.6 million casualties annually and 2 billion people being infected, tuberculosis is still one of the most pressing healthcare challenges. Here we report on the new computational docking algorithm FRIGATE which unites continuous local optimization techniques (conjugate gradient method) with an...

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Detalles Bibliográficos
Autores principales:	Scheich, Christoph, Szabadka, Zoltán, Vértessy, Beáta, Pütter, Vera, Grolmusz, Vince, Schade, Markus
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Public Library of Science 2011
Materias:	Research Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3229595/ https://www.ncbi.nlm.nih.gov/pubmed/22164290 http://dx.doi.org/10.1371/journal.pone.0028428

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