Ligity: a non-superpositional, knowledge-based approach to virtual screening
We present Ligity, a hybrid ligand-structure-based, non-superpositional method for virtual screening of large databases of small molecules. Ligity uses the relative spatial distribution of pharmacophoric interaction points (PIPs) derived from the conformations of small molecules. These are compared...
| Main Authors: | , , , , |
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| Format: | Journal article |
| Published: |
American Chemical Society
2019
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