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Figure 5
Change in polar hydrogen ADP accuracy (measured with average MSDcorr) when the data resolution is limited to d = 0.8 Å plotted against the scale parameter q for scaling low-resolution refinement (dmin = 0.8 Å) non-hydrogen ADPs to values from high-resolution refinement. Limiting the resolution deteriorated the accuracy of the ADPs when parameter q was close to 1 (points inside the blue box) and improved otherwise (points inside the orange box). |
IUCrJ
ISSN: 2052-2525
MATERIALS | COMPUTATION
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