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Recognizing and validating ligands with CheckMyBlob
Structure-guided drug design depends on the correct identification of ligands in crystal structures of protein complexes. However, the interpretation of the electron density maps is challenging and often burdened with confirmation bias. Ligand identification can be aided by automatic methods such as...
Autores principales: | Brzezinski, Dariusz, Porebski, Przemyslaw J, Kowiel, Marcin, Macnar, Joanna M, Minor, Wladek |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Oxford University Press
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8262754/ https://www.ncbi.nlm.nih.gov/pubmed/33905501 http://dx.doi.org/10.1093/nar/gkab296 |
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