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Automated identification of crystallographic ligands using sparse-density representations
A novel procedure for the automatic identification of ligands in macromolecular crystallographic electron-density maps is introduced. It is based on the sparse parameterization of density clusters and the matching of the pseudo-atomic grids thus created to conformationally variant ligands using math...
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| Main Authors: | , |
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| Format: | Artigo |
| Language: | Inglês |
| Published: |
International Union of Crystallography
2014
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| Subjects: | |
| Online Access: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4089483/ https://ncbi.nlm.nih.gov/pubmed/25004962 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1107/S1399004714008578 |
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