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Virtual ligand screening: strategies, perspectives and limitations
In contrast to high-throughput screening, in virtual ligand screening (VS), compounds are selected using computer programs to predict their binding to a target receptor. A key prerequisite is knowledge about the spatial and energetic criteria responsible for protein–ligand binding. The concepts and...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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Elsevier Ltd.
2006
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7108249/ https://www.ncbi.nlm.nih.gov/pubmed/16793526 http://dx.doi.org/10.1016/j.drudis.2006.05.012 |