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- W3088003043 abstract "Abstract Iris validation is a Python package created to represent comprehensive per‐residue validation metrics for entire protein chains in a compact, readable and interactive view. These metrics can either be calculated by Iris, or by a third‐party program such as MolProbity . We show that those parts of a protein model requiring attention may generate ripples across the metrics on the diagram, immediately catching the modeler's attention. Iris can run as a standalone tool, or be plugged into existing structural biology software to display per‐chain model quality at a glance, with a particular emphasis on evaluating incremental changes resulting from the iterative nature of model building and refinement. Finally, the integration of Iris into the CCP4i2 graphical user interface is provided as a showcase of its pluggable design." @default.
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- W3088003043 date "2020-10-19" @default.
- W3088003043 modified "2023-10-18" @default.
- W3088003043 title "Iris: Interactive all‐in‐one graphical validation of <scp>3D</scp> protein model iterations" @default.
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- W3088003043 doi "https://doi.org/10.1002/pro.3955" @default.
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