bf8f0a482d22f008965fe2f018292ca23c06edf1
- BeamCenterFFTGPU's point surfaces: each spectrum product goes in the place of a spectrum that is finished with (a.a where m's spectrum goes before it is there, a.m and m.m and a^2.m in a's), so the third spectrum buffer goes, and the forward and inverse plans share one work area - they never run at once. The same transforms and products in the same order, so the surfaces are unchanged. 2.6 -> 2.05 GB on a 16 Mpx detector, the largest single holder at the first pass's peak; DeviceMemoryNeeded counts it so. - Rugnux::FirstPassIndexerThreads: a probe pass beside the main line on a card below the take-turns size (gpu_takes_turns(), 12 GB on the first card's total) builds one FFT indexer for its pools instead of two, and indexes its two schemes one after the other. Which indexer indexes a frame does not change what it finds. Measured with the RTX 5080's total read as 8.55 GB: first-pass peak 6.50 -> 5.92 GB (8qaw), 5.76 -> 4.84 GB (4nwv) together with the batched FFT indexer; the speculative probe after the output 6.30 -> 4.35 GB (8qaw). Output unchanged: p.hkl byte-identical on cytc_x10sa, myob_x10sa, 4nwv and 8qaw on this card and on the 8.55 GB simulation; run times unchanged within noise. Co-Authored-By: Claude Opus 5.5 <noreply@anthropic.com>
battery.py timing: a three-set benchmark placed by molecular replacement, checked and timed per step
battery.py timing: a three-set benchmark placed by molecular replacement, checked and timed per step
battery.py timing: a three-set benchmark placed by molecular replacement, checked and timed per step
battery.py timing: a three-set benchmark placed by molecular replacement, checked and timed per step
Jungfraujoch
Application to receive and analyse data from the PSI JUNGFRAU and EIGER detectors, together with
rugnux, its program for processing stored diffraction data - rotation and serial, macromolecular
and small-molecule - from images to merged reflections.
All documentation is now placed in docs/ subdirectory and for the current version hosted on Jungfraujoch Read The Docs page.
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