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.jpg): Failed to open stream: No such file or directory in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 117 Acta+Crystallogr+D+Struct+Biol
2017 ; 73
(Pt 3
): 203-210
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Tools for ligand validation in Coot
#MMPMID28291755
Emsley P
Acta Crystallogr D Struct Biol
2017[Mar]; 73
(Pt 3
): 203-210
PMID28291755
show ga
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
the relative merits of the particular ligand in the protein-ligand complex of
interest by means of `sliders' akin to those now available for each accession
code on the wwPDB websites.