Surface optimization from EDTSurf #971
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Now the cube calculation step is 100 - 200x faster (QElapsedTimer) Signed-off-by: Aritz Erkiaga <aerkiaga3@gmail.com>
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Here are the build results |
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Here are the build results |
Signed-off-by: Aritz Erkiaga <aerkiaga3@gmail.com>
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Here are the build results |
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Here are the build results |
ghutchis
added
the
speed
ghutchis
changed the title
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It seems like this is part of #972 -- I'm just going to review there. |
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That's right, I should probably close this? |
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Now the cube calculation step is 100 - 200x faster (QElapsedTimer).
Basically, this involves iterating over atoms rather than cubes, then for each atom visiting all cubes taken up by it, and only those.
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