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Ligity: A Non-Superpositional, Knowledge-Based Approach to Virtual Screening
[Image: see text] 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. T...
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| Publicado no: | J Chem Inf Model |
|---|---|
| Main Authors: | , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American Chemical
Society
2019
|
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7007185/ https://ncbi.nlm.nih.gov/pubmed/31117509 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.8b00779 |
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