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Automated ligand fitting by core-fragment fitting and extension into density

A procedure for fitting of ligands to electron-density maps by first fitting a core fragment of the ligand to density and then extending the remainder of the ligand into density is presented. The approach was tested by fitting 9327 ligands over a wide range of resolutions (most are in the range 0.8–...

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Detalhes bibliográficos
Main Authors: Terwilliger, Thomas C., Klei, Herbert, Adams, Paul D., Moriarty, Nigel W., Cohn, Judith D.
Formato: Artigo
Idioma:Inglês
Publicado em: International Union of Crystallography 2006
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2745883/
https://ncbi.nlm.nih.gov/pubmed/16855309
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1107/S0907444906017161
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