Tools for ligand validation inCoot

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Tools for ligand validation in Coot

Coot is a molecular-graphics program primarily aimed at model building using X-ray data. Recently, tools for the manipulation and representation of ligands have been introduced. Here, these new tools for ligand validation and comparison are described. Ligands in the wwPDB have been scored by density-fit, distortion and atom-clash metrics. The distributions of these scores can be used to assess ...

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ژورنال

عنوان ژورنال: Acta Crystallographica Section D Structural Biology

سال: 2017

ISSN: 2059-7983

DOI: 10.1107/s2059798317003382