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AlphaSpace 2.0: Representing Concave Biomolecular Surfaces using Beta-Clusters
Modern rational modulator design and structure-function characterization often concentrate on concave regions of biomolecular surfaces, ranging from well-defined small-molecule binding sites to large protein-protein interaction interfaces. Here we introduce beta-cluster as a pseudomolecular represen...
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| Publicat a: | J Chem Inf Model |
|---|---|
| Autors principals: | , , , |
| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
2020
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| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7093224/ https://ncbi.nlm.nih.gov/pubmed/31995373 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.9b00652 |
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