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The XChemExplorer graphical workflow tool for routine or large-scale protein–ligand structure determination
XChemExplorer (XCE) is a data-management and workflow tool to support large-scale simultaneous analysis of protein–ligand complexes during structure-based ligand discovery (SBLD). The user interfaces of established crystallographic software packages such as CCP4 [Winn et al. (2011 ▸), Acta Cryst. D...
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/PMC5349439/ https://www.ncbi.nlm.nih.gov/pubmed/28291762 http://dx.doi.org/10.1107/S2059798316020234 |