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WONKA and OOMMPPAA: analysis of protein–ligand interaction data to direct structure-based drug design
In this work, two freely available web-based interactive computational tools that facilitate the analysis and interpretation of protein–ligand interaction data are described. Firstly, WONKA, which assists in uncovering interesting and unusual features (for example residue motions) within ensembles o...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5349440/ https://www.ncbi.nlm.nih.gov/pubmed/28291763 http://dx.doi.org/10.1107/S2059798316009529 |