Fragment-centric topographic mapping method guides the understanding of ABCG2-inhibitor interactions
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DOI: 10.1039/c8ra09789e
Abstract: Our study gains insight into the development of novel specific ABCG2 inhibitors, and develops a comprehensive computational strategy to understand protein ligand interaction with the help of AlphaSpace, a fragment-centric topographic mapping tool. read more here.
Keywords: centric topographic; topographic mapping; fragment centric; guides understanding ... See more keywords