The combination of high-content small-molecule screening information with computational tools offers the opportunity to obtain structure-activity relationships from complex cell-based data.
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Lang, P. SAR by HCS. Nat Chem Biol 4, 18–19 (2008). https://doi.org/10.1038/nchembio0108-18
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DOI: https://doi.org/10.1038/nchembio0108-18