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Deterministic Pharmacophore Detection via Multiple Flexible Alignment of Drug-Like Molecules
We present a novel highly efficient method for the detection of a pharmacophore from a set of drug-like ligands that interact with a target receptor. A pharmacophore is a spatial arrangement of physico-chemical features in a ligand that is essential for the interaction with a specific receptor. In t...
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| Main Authors: | , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Mary Ann Liebert, Inc., publishers
2008
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2699263/ https://ncbi.nlm.nih.gov/pubmed/18662104 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1089/cmb.2007.0130 |
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