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Statistical Potential for Modeling and Ranking of Protein-Ligand Interactions
Applications in structural biology and medicinal chemistry require protein-ligand scoring functions for two distinct tasks: (i) ranking different poses of a small molecule in a protein binding site; and (ii) ranking different small molecules by their complementarity to a protein site. Using probabil...
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| Main Authors: | , , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2011
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3246566/ https://ncbi.nlm.nih.gov/pubmed/22014038 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci200377u |
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