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Description

For LigandScout-based pharmacophore screening (Wolber & Langer, 2004) libraries were converted to ldb format using the idbgen utility, applying the icon best preset and more (600) conformers to ensure adequate sampling of ligand flexibility

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doi: 10.1038/s41586-019-1707-0 55 AnandhanADodsonMSchmidlinCJLiuPZhangDD

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