The rc178 branch continued after #88 was squash-merged; this is its content fromb9ada7914(the tree #88 squashed) to094eee31a, as one change on main. The individual commits stay on the rc178 branch: - still battery: --cold evicts each set's input from the page cache; Alvra pixel masks; manifest fixes - AGIPD: converter to one rigid panel per module, int16 photons, mask folded in; still battery reads the converted sets - DetectorModules: panel look-up by id, plane -> panel, plane bounds and a per-pixel walk; mask size checked - tests: [PanelLayout] equivalence harness, stacked vs assembled panel layout - Dense per-pixel maps through the panel table (panel layout stage 1) - Panel id on spots and the panel table in the start message - Viewer and preview show a panel detector as it lies on the detector plane - Panel layout stage 3: per-panel spot finding (CPU+GPU, CCL) and raster algorithms on the plane raster - Panel layout stage 2: prediction and Bragg integration through the panel table - XTC reader: frames handed up as stored, streams indexed in parallel - XFEL reader: integer frames stay integer, one gain, placement by panel - EXTERNAL_TEST_DATA_STILLS.md: images used vs the entry for every set; drop "Not in the battery" - still battery: EuXFEL sets read the depositors' Cheetah CXI files directly; AGIPD converter removed - float32_to_int16.py: a non-finite pixel becomes -32768, the int16 error marker, not a zero count - CrystFEL geometry: read the pixel masks and bad regions instead of ignoring them - Panel layout stage 5: the XFEL reader hands up the stored frame and its panel table - Panel table persisted in NXmx; modulation grid and pre-scan memo key on the plane - still battery: Alvra sets take their pixel mask from the CrystFEL geometry, not --mask-good - still battery: take the deposited model as mmCIF where the RCSB has no PDB-format file - still battery: dimple gets PDB-format coordinates converted from an mmCIF-only deposition - stills fixed cost: geometry refinement and pre-scan do the same work in less wall time - stills geometry sample and trial spot finding run as many workers as the image pass - Stills integration: background ring reach measured on empty apertures, radial curvature from the whole frame - StillsPartialityRefine: the partiality width is the run's, measured on the crystals, not the prediction window's - MergeOnTheFly: capture term and multiplicative outlier band for the stills merge (both opt-in) - Stills given a cell: the written cell is the mean over the frames that are merged - Stills: the radial curvature correction decided per run on the same empty apertures - StillsPartialityRefine: measure the run width only on shells with signal - Stills pre-scan: report the paired z of the radial-correction comparison - module placement: the five concurrent fits each keep every thread - still battery: score R-free against the deposited data through the same dimple protocol - still battery: the R-free target is the lower of the deposition's dimple and published values - Stills: background clip follows the radial curve; signal disk from the lattice spacing - Stills keep an overloaded observation as a lower bound instead of dropping it - Stills: drop the lattice-spacing signal disk; the correction decision back on the plain clip - battery: R-free against the deposition without refinement only, one protocol for rotation and stills - still battery: EuXFEL sets run on a 2,000-image subset for now - stills geometry refinement: fit the detector distance and the cell together - stills geometry refinement: a distance given with --detector-distance is held in the joint fit - Metal integration engine: back to its panel-s5 kernels; Mac stills keep the old clip, no saturation count - Metal integration test: the CPU comparison runs on a rotation experiment - Stills: kept overloads go back to the drop where they are not concentrated at low resolution - stills distance search: an absolute 30-3000 mm scan, a sample found without d-limits, the fit iterated - battery results: XFEL still battery 20261022-1358 on rc1780cf62452c- 12 sets, cold, R_free unrefined - battery results: still summary gains the resolution of our merge and of the deposition - Pre-scan masks a pixel at the saturation limit on most frames, as one holding the error value - Stills keep an overload as a lower bound only where it has pixels at the limit; run-level gate removed - XFEL reader: a per-frame mask is read the way the frames are, its chunk inflated outside the HDF5 lock - stills distance search: every centre scanned with a wider acceptance, a larger sample where nothing indexes - rugnux usage: --beam-center-check describes the absolute 30-3000 mm stills distance scan, not the old 60-160 % grid - stills: detector tilt refined in the geometry pre-pass, kept where held-out frames agree - CLAUDE.md: the changelog is written once, just before the merge into main - condensed one-liners of what users get - broker: serve the placed model and its maps of the last rugnux live run (/rugnux/model.cif, /rugnux/map.ccp4) - frontend: Mol* viewer of the placed model and its density on the Rugnux live page - writer: _model.cif from rugnux live keeps the input model's metadata, as the served model.cif does - rugnux live maps: one unit cell centred on the model; the viewer opens on all of it - Anomalous difference map: ANOM/PHANOM in _maps.mtz, /rugnux/map.ccp4?type=anom, a magenta mesh in the viewer - Mol* viewer: open with the maps drawn within 10 A of the centre of view - Mol* viewer: aaredb's structure-viewer setup, on a black stage - rugnux: the gain of a stills file that states none is read off its single-photon peak where the background resolves photons - Mol* viewer: in line with AareDB's StructureView at its current head (8ece2c2) - ACKNOWLEDGEMENT: the web frontend's Mol* viewer follows AareDB's setup (G. Gotthard, PSI) - stills tilt decision: the modules stay where the run placed them - still battery: no distance pins and no per-set tuning flags; gain from the data except where a file's baseline hides it - battery results: rc178 6f6f69 - full still battery and full rotation battery with REFMAC - Bragg integration: a CCD rotation sweep's sigmas at the measured gain, intensities in photons - BackgroundGain: the gain of a frame that resolves photons is the spacing of its photon peaks, so a baseline left in the frame no longer hides it - ShadowFinder: measure the background's azimuthal modulation instead of predicting it from the polarization - BackgroundGain: one gain estimate for rotation and stills; the still battery no longer gives EuXFEL 152 its gain - ShadowFinder: measure the modulation robustly under a wide one-sided shadow - ShadowFinderTest: a one-sided shadow is not fitted as part of the background's modulation - ShadowFinder: back to the predicted polarization factor, in the plane the background shows - MXAnalysisAfterFPGA: the Bragg engine's edge mask in the image's layout, so raw / untransformed FPGA runs start again - battery results: still battery on rc178 e54f55 replaces the earlier rc178 still tables - XFELReader: per-frame mask and photon conversion without a library call or a branch per pixel - stills geometry trial: the hypotheses a search asks are indexed side by side - stills tilt decision: the fits start beside the pre-scan and the geometry trial - XFELReader: a deflated frame is inflated and converted a piece at a time, while it is in the cache - XFELReader: a byte-shuffled frame is unshuffled a piece at a time, a whole pixel per step - GeometryRefiner: residuals carry only the blocks a fit moves; beam and distance one block - GeometryRefiner: a spot's residual differentiates its observed and predicted halves apart - docs: EXTERNAL_TEST_DATA lists every open-arm battery set, with corrected values and counts - battery: doc_check.py cross-checks the manifests against the dataset pages - stills module placement: the placement fit gets half the threads, each held-out fit an eighth - still battery: the EuXFEL sets run on all their frames, as the published still runs did - battery results: still battery on rc178 a0ce6c, cold on a quiet machine, replaces the earlier rc178 table - macOS build: explicit size_t in the XFEL reader's row bounds; parentheses in the CPU preprocessor's select Co-Authored-By: Claude Opus 5.5 <noreply@anthropic.com> Claude-Session: https://claude.ai/code/session_015CeEGgpKdfkCTJb3YNMJcu
329 lines
16 KiB
C++
329 lines
16 KiB
C++
// SPDX-FileCopyrightText: 2024 Filip Leonarski, Paul Scherrer Institute <filip.leonarski@psi.ch>
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// SPDX-License-Identifier: GPL-3.0-only
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#include <algorithm>
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#include <bit>
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#include <bitset>
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#include <cmath>
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#include "ImageSpotFinderCPU.h"
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#include "StrongPixelSet.h"
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ImageSpotFinderCPU::ImageSpotFinderCPU(int32_t in_width, int32_t in_height)
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: ImageSpotFinder(in_width, in_height), first_pass_buffer(OutputSize(), 0) {}
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void ImageSpotFinderCPU::Detect(const ImagePreprocessorBuffer &image,
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const SpotFindingSettings &settings) {
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// Two passes, as ImageSpotFinderGPU::Detect does. The second recomputes every local background
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// with the pixels the first found strong taken out of it, and keeps those pixels strong. It
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// matters because a spot wide enough to reach into its own background window inflates the mean
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// and variance it is then tested against, so its outer pixels fail the SNR test on a single
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// pass. The GPU has always done this; running one pass here made the two finders return
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// different spot lists for the same frame.
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DetectPass(image, settings, nullptr, first_pass_buffer);
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DetectPass(image, settings, first_pass_buffer.data(), output_buffer);
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}
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namespace {
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// The local-box SNR test of one pixel. sum/sum2/valid are its window's, centre pixel included.
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bool StrongInWindow(int64_t pxl_val, int64_t sum, int64_t sum2, int64_t valid,
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const SpotFindingSettings &settings, float strong2) {
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const int64_t sum_local = sum - pxl_val;
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const int64_t sum2_local = sum2 - pxl_val * pxl_val;
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const int64_t valid_local = valid - 1;
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const int64_t var = valid_local * sum2_local - (sum_local * sum_local);
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const int64_t in_minus_mean = pxl_val * valid_local - sum_local;
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return (pxl_val == INT32_MAX) // saturated pixel, or strong in the previous pass, is accepted always
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|| ((pxl_val != INT32_MIN && // pixel is not bad pixel
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valid_local > ImageSpotFinder::MIN_VALID_PIXELS && // too many bad pixels around will give poor statistics
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(pxl_val > settings.photon_count_threshold) && // pixel is above count threshold
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(in_minus_mean > 0) && // pixel value is larger than mean
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(in_minus_mean * in_minus_mean > static_cast<int64_t>(std::ceil(var * strong2)))));
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// pixel is above SNR threshold
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}
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// Adds row `in` to the vertical sums and takes row `out` out of them; a row of INT32_MIN is no row. A
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// bad or saturated pixel adds 0. Written without branches - both rows are always read, so no load is
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// conditional - and as a function of its own, so that the loop vectorises whatever it is inlined into;
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// integer sums, so the same totals as pixel by pixel.
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void SlideVertical(const int32_t *in, const int32_t *out, int32_t width,
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int64_t *sum, int64_t *sum2, uint16_t *valid) {
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for (int32_t col = 0; col < width; col++) {
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const int64_t a = in[col];
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const int64_t r = out[col];
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const bool a_ok = a != INT32_MAX && a != INT32_MIN;
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const bool r_ok = r != INT32_MAX && r != INT32_MIN;
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const int64_t a_v = a_ok ? a : 0;
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const int64_t r_v = r_ok ? r : 0;
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sum[col] += a_v - r_v;
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sum2[col] += a_v * a_v - r_v * r_v;
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valid[col] += static_cast<uint16_t>(a_ok - r_ok);
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}
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}
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} // namespace
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void ImageSpotFinderCPU::DetectAt(const ImagePreprocessorBuffer &image, const SpotFindingSettings &settings,
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const std::vector<uint32_t> &candidates,
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const std::function<void(int32_t)> &fill_row) {
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candidate_windows.clear();
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// Filled in by DetectPass as the candidates of each row become known.
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first_pass_needed.assign(static_cast<size_t>(height) * ((width + 31) / 32), 0);
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DetectPass(image, settings, nullptr, first_pass_buffer, candidates.data(), fill_row);
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std::fill(output_buffer.begin(), output_buffer.end(), 0);
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const float strong2 = settings.signal_to_noise_threshold * settings.signal_to_noise_threshold;
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const auto first_pass = [&](int32_t pxl) { return (first_pass_buffer[pxl / 32] >> (pxl % 32)) & 1U; };
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for (const auto &c : candidate_windows) {
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const int32_t line = c.pxl / width;
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const int32_t col = c.pxl % width;
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const PanelBox &b = *c.panel;
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int64_t sum = c.sum, sum2 = c.sum2, valid = c.valid;
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// Take out of the window what the second pass does not count: the first pass's strong pixels.
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for (int32_t y = std::max(line - NBX, b.y0); y <= std::min(line + NBX, b.y1 - 1); y++) {
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const int32_t first = y * width + std::max(col - NBX, b.x0);
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const int32_t last = y * width + std::min(col + NBX, b.x1 - 1);
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for (int32_t w = first / 32; w <= last / 32; w++) {
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uint32_t bits = first_pass_buffer[w];
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if (w == first / 32)
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bits &= UINT32_MAX << (first % 32);
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if (w == last / 32 && last % 32 != 31)
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bits &= (1U << (last % 32 + 1)) - 1;
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while (bits) {
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const int32_t q = w * 32 + std::countr_zero(bits);
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bits &= bits - 1;
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const int64_t v = image[q];
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if (v != INT32_MAX && v != INT32_MIN) {
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sum -= v;
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sum2 -= v * v;
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valid -= 1;
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}
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}
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}
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}
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const int64_t pxl_val = first_pass(c.pxl) ? INT32_MAX : image[c.pxl];
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if (StrongInWindow(pxl_val, sum, sum2, valid, settings, strong2))
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output_buffer[c.pxl / 32] |= 1U << (c.pxl % 32);
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}
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}
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void ImageSpotFinderCPU::DetectPass(const ImagePreprocessorBuffer &image,
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const SpotFindingSettings &settings,
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const uint32_t *prev_strong,
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std::vector<uint32_t> &out_buffer,
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const uint32_t *candidates,
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const std::function<void(int32_t)> &fill_row) {
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for (int i = 0; i < OutputSize(); i++)
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out_buffer[i] = 0;
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// A pixel found strong by the previous pass reads as INT32_MAX, which the accumulation below
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// already skips and the acceptance test below already takes as strong - the same substitution
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// the GPU kernel makes when it reads prev_out.
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auto value_at = [&](int32_t pxl) -> int32_t {
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if (prev_strong && (prev_strong[pxl / 32] & (1U << (pxl % 32))))
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return INT32_MAX;
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return image[pxl];
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};
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// Panel by panel (one panel, the whole image, without a module table): every window, sum and
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// run below is clipped to the panel's box, so nothing on one panel is measured against another.
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// The bits of a row are gathered 32 at a time and or-ed in at a word end and at the panel's edge.
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std::bitset<32> out = 0;
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const auto put = [&](int32_t pxl, bool strong, bool row_end) {
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if (strong)
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out.set(pxl % 32);
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if (pxl % 32 == 31 || row_end) {
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out_buffer[pxl / 32] |= out.to_ulong();
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out.reset();
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}
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};
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if (settings.signal_to_noise_threshold <= 0.0) {
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if (settings.photon_count_threshold > 0) {
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for (const auto &b : panels)
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for (int32_t line = b.y0; line < b.y1; line++)
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for (int32_t col = b.x0; col < b.x1; col++) {
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const int32_t pxl = line * width + col;
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const int32_t pxl_val = value_at(pxl);
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put(pxl, pxl_val == INT32_MAX || (pxl_val > settings.photon_count_threshold && pxl_val != INT32_MIN),
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col == b.x1 - 1);
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}
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}
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return;
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}
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float strong2 = settings.signal_to_noise_threshold * settings.signal_to_noise_threshold;
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// Sum and sum of squares of (2*NBY+1) vertical elements
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// These are updated after each line is finished
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// 64-bit integer guarantees calculations are made without rounding errors
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std::vector<int64_t> sum_vert(width, 0);
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std::vector<int64_t> sum2_vert(width, 0);
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std::vector<uint16_t> valid_vert(width, 0);
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const int32_t *img = image.data();
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const int32_t w = width;
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int64_t *sv = sum_vert.data();
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int64_t *sv2 = sum2_vert.data();
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uint16_t *vv = valid_vert.data();
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const std::vector<int32_t> no_row(width, INT32_MIN);
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const int32_t nblocks = (width + 31) / 32;
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// The rows fill_row has been asked for; a row shared by panels side by side is filled once.
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std::vector<uint8_t> row_filled(fill_row ? height : 0, 0);
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for (const auto &b : panels) {
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const int32_t bw = b.x1 - b.x0;
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// The first pass's bits are read only inside the window of a candidate (and at the candidate),
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// so with candidates it tests only the pixels of the row/column blocks such a window reaches;
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// the bits it leaves unset there are never read. Those blocks are marked from each row's
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// candidates as the row enters the vertical sums below, which is before any row within NBX of
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// it is tested - so the candidates themselves can be filled in a row at a time (fill_row),
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// while the row is in cache.
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const auto new_row = [&](int32_t r) {
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if (!candidates)
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return;
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if (fill_row && !row_filled[r]) {
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fill_row(r);
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row_filled[r] = 1;
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}
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const int32_t first = r * width + b.x0;
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const int32_t last = r * width + b.x1 - 1;
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for (int32_t word = first / 32; word <= last / 32; word++) {
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uint32_t bits = candidates[word];
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if (word == first / 32)
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bits &= UINT32_MAX << (first % 32);
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if (word == last / 32 && last % 32 != 31)
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bits &= (1U << (last % 32 + 1)) - 1;
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for (; bits; bits &= bits - 1) {
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const int32_t col = word * 32 + std::countr_zero(bits) - r * width;
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for (int32_t y = std::max(r - NBX, b.y0); y <= std::min(r + NBX, b.y1 - 1); y++)
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for (int32_t k = std::max(col - NBX, b.x0) / 32; k <= std::min(col + NBX, b.x1 - 1) / 32; k++)
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first_pass_needed[static_cast<size_t>(y) * nblocks + k] = 1;
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}
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}
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};
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// Add the row entering the window (line_in) and take out the one leaving it (line_out); -1 is
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// no row. A pixel strong in the previous pass is not counted either; SlideVertical adds it with
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// the rest of its row and it is taken out again below - there are few, and the sums are
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// integers, so the totals are the same as never adding it.
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auto slide_vert = [&](int line_in, int line_out) {
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SlideVertical(line_in >= 0 ? img + static_cast<size_t>(line_in) * w + b.x0 : no_row.data(),
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line_out >= 0 ? img + static_cast<size_t>(line_out) * w + b.x0 : no_row.data(), bw,
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sv + b.x0, sv2 + b.x0, vv + b.x0);
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if (!prev_strong)
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return;
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// sign = +1 takes out what line_in added, -1 puts back what line_out took out.
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const auto uncount_strong = [&](int line, int64_t sign) {
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const int32_t row = line * w;
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const int32_t first = row + b.x0, last = row + b.x1 - 1;
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for (int32_t word = first / 32; word <= last / 32; word++) {
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uint32_t bits = prev_strong[word];
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if (word == first / 32)
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bits &= UINT32_MAX << (first % 32);
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if (word == last / 32 && last % 32 != 31)
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bits &= (1U << (last % 32 + 1)) - 1;
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for (; bits; bits &= bits - 1) {
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const int32_t pxl = word * 32 + std::countr_zero(bits);
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const int64_t v = img[pxl];
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if (v == INT32_MAX || v == INT32_MIN)
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continue;
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sv[pxl - row] -= sign * v;
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sv2[pxl - row] -= sign * v * v;
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vv[pxl - row] -= static_cast<uint16_t>(sign);
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}
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}
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};
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if (line_in >= 0)
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uncount_strong(line_in, 1);
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if (line_out >= 0)
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uncount_strong(line_out, -1);
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};
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std::fill(sum_vert.begin() + b.x0, sum_vert.begin() + b.x1, 0);
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std::fill(sum2_vert.begin() + b.x0, sum2_vert.begin() + b.x1, 0);
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std::fill(valid_vert.begin() + b.x0, valid_vert.begin() + b.x1, 0);
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for (int line = b.y0; line < std::min(b.y0 + NBX, b.y1); line++) {
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new_row(line);
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slide_vert(line, -1);
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}
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for (int line = b.y0; line < b.y1; line++) {
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if (line + NBX < b.y1)
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new_row(line + NBX);
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slide_vert(line + NBX < b.y1 ? line + NBX : -1, line - (NBX + 1) >= b.y0 ? line - (NBX + 1) : -1);
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if (candidates) {
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// Only the runs of 32-column blocks whose result is read (first_pass_needed; every
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// candidate lies in one). Each run starts its window from the vertical sums over the
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// columns it covers there - integers, so the same sums the running window holds at
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// that column - and slides it as below; the bits outside the runs stay 0, as below.
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const uint8_t *needed = first_pass_needed.data() + static_cast<size_t>(line) * nblocks;
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for (int32_t k = b.x0 / 32; k <= (b.x1 - 1) / 32;) {
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if (!needed[k]) { k++; continue; }
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const int32_t c0 = std::max(k * 32, b.x0);
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while (k <= (b.x1 - 1) / 32 && needed[k]) k++;
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const int32_t c1 = std::min(k * 32, b.x1);
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int64_t sum = 0, sum2 = 0, valid = 0;
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for (int32_t c = std::max(c0 - NBX, b.x0); c <= std::min(c0 + NBX, b.x1 - 1); c++) {
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sum += sum_vert[c];
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sum2 += sum2_vert[c];
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valid += valid_vert[c];
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}
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for (int32_t col = c0; col < c1; col++) {
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if (col > c0) {
|
|
if (col + NBX < b.x1) {
|
|
sum += sum_vert[col + NBX];
|
|
sum2 += sum2_vert[col + NBX];
|
|
valid += valid_vert[col + NBX];
|
|
}
|
|
if (col - NBX - 1 >= b.x0) {
|
|
sum -= sum_vert[col - NBX - 1];
|
|
sum2 -= sum2_vert[col - NBX - 1];
|
|
valid -= valid_vert[col - NBX - 1];
|
|
}
|
|
}
|
|
const int32_t pxl = line * width + col;
|
|
if (candidates[pxl / 32] & (1U << (pxl % 32)))
|
|
candidate_windows.push_back({pxl, sum, sum2, valid, &b});
|
|
if (StrongInWindow(value_at(pxl), sum, sum2, valid, settings, strong2))
|
|
out_buffer[pxl / 32] |= 1U << (pxl % 32);
|
|
}
|
|
}
|
|
continue;
|
|
}
|
|
|
|
int64_t sum = 0;
|
|
int64_t sum2 = 0;
|
|
int64_t valid = 0;
|
|
|
|
for (int col = b.x0; col < std::min(b.x0 + NBX, b.x1); col++) {
|
|
sum += sum_vert[col];
|
|
sum2 += sum2_vert[col];
|
|
valid += valid_vert[col];
|
|
}
|
|
|
|
for (int col = b.x0; col < b.x1; col++) {
|
|
if (col + NBX < b.x1) {
|
|
sum += sum_vert[col + NBX];
|
|
sum2 += sum2_vert[col + NBX];
|
|
valid += valid_vert[col + NBX];
|
|
}
|
|
|
|
if (col - NBX - 1 >= b.x0) {
|
|
sum -= sum_vert[col - NBX - 1];
|
|
sum2 -= sum2_vert[col - NBX - 1];
|
|
valid -= valid_vert[col - NBX - 1];
|
|
}
|
|
const int32_t pxl = line * width + col;
|
|
put(pxl, StrongInWindow(value_at(pxl), sum, sum2, valid, settings, strong2), col == b.x1 - 1);
|
|
}
|
|
}
|
|
}
|
|
}
|