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Target-based drug discovery through inversion of quantitative structure-drug-property relationships and molecular simulation: CA IX-sulphonamide complexes

In this work, a target-based drug screening method is proposed exploiting the synergy effect of ligand-based and structure-based computer-assisted drug design. The new method provides great flexibility in drug design and drug candidates with considerably lower risk in an efficient manner. As a model...

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Detalles Bibliográficos
Autores principales:	Žuvela, Petar, Liu, J. Jay, Yi, Myunggi, Pomastowski, Paweł P., Sagandykova, Gulyaim, Belka, Mariusz, David, Jonathan, Bączek, Tomasz, Szafrański, Krzysztof, Żołnowska, Beata, Sławiński, Jarosław, Supuran, Claudiu T., Wong, Ming Wah, Buszewski, Bogusław
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Taylor & Francis 2018
Materias:	Research Paper
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6151961/ https://www.ncbi.nlm.nih.gov/pubmed/30220229 http://dx.doi.org/10.1080/14756366.2018.1511551

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