FTMAP: extended protein mapping with user-selected probe molecules

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FTMAP: extended protein mapping with user-selected probe molecules

Binding hot spots, protein sites with high-binding affinity, can be identified using X-ray crystallography or NMR by screening libraries of small organic molecules that tend to cluster at such regions. FTMAP, a direct computational analog of the experimental screening approaches, globally samples the surface of a target protein using small organic molecules as probes, finds favorable positions,...

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ژورنال

عنوان ژورنال: Nucleic Acids Research

سال: 2012

ISSN: 0305-1048,1362-4962

DOI: 10.1093/nar/gks441