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EDS radius?

Open BobHanson opened this issue 7 years ago • 2 comments

It looks to me that LiteMol is overextending on radius. This selection should show essentially nothing.

image

BobHanson avatar Jan 18 '18 14:01 BobHanson

This is because DensityServer (now) responds with a superset of the original query box and LiteMol currently does not do any post-processing of the received data and just displays the box as it is (including the skew introduced by the spacegroup). I was planning to truncate the data similar to how you now do it in Jmol but didn't get to that yet.

dsehnal avatar Jan 18 '18 14:01 dsehnal

Sure, that makes sense. Beautiful rendering.

On Thu, Jan 18, 2018 at 8:52 AM, David Sehnal [email protected] wrote:

This is because DensityServer (now) responds with a superset of the original query box and LiteMol currently does not do any post-processing of the received data and just displays the box as it is (including the skew introduced by the spacegroup). I was planning to truncate the data similar to how you now do it in Jmol but didn't get to that yet.

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BobHanson avatar Jan 18 '18 15:01 BobHanson