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authorThomas White <taw@physics.org>2017-03-24 14:48:00 +0100
committerThomas White <taw@physics.org>2017-03-24 14:48:00 +0100
commit1f613c288763a165b6e803d918f9fd8613996212 (patch)
tree957275219c6d87fe36cb3b6091e8dc90358aa0ae /libcrystfel
parent48f66a24733cca076b56ef5981f79ff690f7e39c (diff)
parent425619c37c3973cd354a667a61e84ccab7d81572 (diff)
Merge branch 'valerio/peakfinder8'
Diffstat (limited to 'libcrystfel')
-rw-r--r--libcrystfel/Makefile.am6
-rw-r--r--libcrystfel/src/peakfinder8.c1233
-rw-r--r--libcrystfel/src/peakfinder8.h50
-rw-r--r--libcrystfel/src/peaks.c28
-rw-r--r--libcrystfel/src/peaks.h14
5 files changed, 1322 insertions, 9 deletions
diff --git a/libcrystfel/Makefile.am b/libcrystfel/Makefile.am
index d7142f6a..8af82552 100644
--- a/libcrystfel/Makefile.am
+++ b/libcrystfel/Makefile.am
@@ -10,7 +10,8 @@ libcrystfel_la_SOURCES = src/reflist.c src/utils.c src/cell.c src/detector.c \
src/render.c src/index.c src/dirax.c src/mosflm.c \
src/cell-utils.c src/integer_matrix.c src/crystal.c \
src/xds.c src/integration.c src/predict-refine.c \
- src/histogram.c src/events.c src/felix.c
+ src/histogram.c src/events.c src/felix.c \
+ src/peakfinder8.c
if HAVE_FFTW
libcrystfel_la_SOURCES += src/asdf.c
@@ -30,7 +31,8 @@ libcrystfel_la_include_HEADERS = ${top_srcdir}/version.h \
src/integer_matrix.h src/crystal.h \
src/xds.h src/predict-refine.h \
src/integration.h src/histogram.h \
- src/events.h src/asdf.h src/felix.h
+ src/events.h src/asdf.h src/felix.h \
+ src/peakfinder8.h
AM_CPPFLAGS = -DDATADIR=\""$(datadir)"\" -I$(top_builddir)/lib -Wall
AM_CPPFLAGS += -I$(top_srcdir)/lib @LIBCRYSTFEL_CFLAGS@
diff --git a/libcrystfel/src/peakfinder8.c b/libcrystfel/src/peakfinder8.c
new file mode 100644
index 00000000..f6e70223
--- /dev/null
+++ b/libcrystfel/src/peakfinder8.c
@@ -0,0 +1,1233 @@
+/*
+ * peakfinder8.c
+ *
+ * The peakfinder8 algorithm
+ *
+ * Copyright © 2012-2017 Deutsches Elektronen-Synchrotron DESY,
+ * a research centre of the Helmholtz Association.
+ *
+ * Authors:
+ * 2017 Valerio Mariani <valerio.mariani@desy.de>
+ * 2017 Anton Barty <anton.barty@desy.de>
+ * 2017 Oleksandr Yefanov <oleksandr.yefanov@desy.de>
+ *
+ * This file is part of CrystFEL.
+ *
+ * CrystFEL is free software: you can redistribute it and/or modify
+ * it under the terms of the GNU General Public License as published by
+ * the Free Software Foundation, either version 3 of the License, or
+ * (at your option) any later version.
+ *
+ * CrystFEL is distributed in the hope that it will be useful,
+ * but WITHOUT ANY WARRANTY; without even the implied warranty of
+ * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
+ * GNU General Public License for more details.
+ *
+ * You should have received a copy of the GNU General Public License
+ * along with CrystFEL. If not, see <http://www.gnu.org/licenses/>.
+ *
+ */
+
+#ifdef HAVE_CONFIG_H
+#include <config.h>
+#endif
+
+#include <math.h>
+#include <stdlib.h>
+
+#include "peakfinder8.h"
+
+
+struct radius_maps
+{
+ float **r_maps;
+ int n_rmaps;
+};
+
+
+struct peakfinder_mask
+{
+ char **masks;
+ int n_masks;
+};
+
+
+struct radial_stats
+{
+ float *roffset;
+ float *rthreshold;
+ float *rsigma;
+ int *rcount;
+ int n_rad_bins;
+};
+
+
+struct peakfinder_panel_data
+{
+ float **panel_data;
+ int *panel_h;
+ int *panel_w;
+ int num_panels;
+};
+
+
+struct peakfinder_intern_data
+{
+ char *pix_in_peak_map;
+ int *infs;
+ int *inss;
+ int *peak_pixels;
+};
+
+
+struct peakfinder_peak_data
+{
+ int num_found_peaks;
+ int *npix;
+ float *com_fs;
+ float *com_ss;
+ int *com_index;
+ float *tot_i;
+ float *max_i;
+ float *sigma;
+ float *snr;
+};
+
+
+static double compute_r_sigma(float *rsigma, int *rcount, float *roffset,
+ int i)
+{
+ return sqrt(rsigma[i] / rcount[i] -
+ ((roffset[i] / rcount[i]) *
+ (roffset[i] / rcount[i])));
+}
+
+
+static void update_radial_stats(float *roffset, float *rsigma, int *rcount,
+ float value, int curr_radius)
+{
+ roffset[curr_radius] += value;
+ rsigma[curr_radius] += (value * value);
+ rcount[curr_radius] += 1;
+}
+
+
+static float get_radius(struct panel p, float fs, float ss)
+{
+ float x, y;
+
+ /* Calculate 3D position of given position, in m */
+ x = (p.cnx + fs * p.fsx + ss * p.ssx);
+ y = (p.cny + fs * p.fsy + ss * p.ssy);
+
+ return sqrt(x * x + y * y);
+}
+
+
+static struct radius_maps *compute_radius_maps(struct detector *det)
+{
+ int i, u, iss, ifs;
+ struct panel p;
+ struct radius_maps *rm = NULL;
+
+ rm = (struct radius_maps *)malloc(sizeof(struct radius_maps));
+ if ( rm == NULL ) {
+ return NULL;
+ }
+
+ rm->r_maps = (float **)malloc(det->n_panels*sizeof(float*));
+ if ( rm->r_maps == NULL ) {
+ free(rm);
+ return NULL;
+ }
+
+ rm->n_rmaps = det->n_panels;
+
+ for( i=0 ; i<det->n_panels ; i++ ) {
+
+ p = det->panels[i];
+ rm->r_maps[i] = (float *)malloc(p.h*p.w*sizeof(float));
+
+ if ( rm->r_maps[i] == NULL ) {
+ for ( u = 0; u<i; u++ ) {
+ free(rm->r_maps[u]);
+ }
+ free(rm);
+ return NULL;
+ }
+
+ for ( iss=0 ; iss<p.h ; iss++ ) {
+ for ( ifs=0; ifs<p.w; ifs++ ) {
+
+ int rmi;
+
+ rmi = ifs + p.w * iss;
+
+ rm->r_maps[i][rmi] = get_radius(p, ifs, iss);
+ }
+ }
+
+ }
+
+ return rm;
+}
+
+
+static void free_radius_maps(struct radius_maps *r_maps)
+{
+ int i;
+
+ for ( i=0 ; i<r_maps->n_rmaps ; i++ ) {
+ free(r_maps->r_maps[i]);
+ }
+ free(r_maps->r_maps);
+ free(r_maps);
+}
+
+
+static struct peakfinder_mask *create_peakfinder_mask(struct image *img,
+ struct radius_maps *rmps,
+ int min_res,
+ int max_res)
+{
+ int i;
+ struct peakfinder_mask *msk;
+
+ msk = (struct peakfinder_mask *)malloc(sizeof(struct peakfinder_mask));
+ msk->masks =(char **) malloc(img->det->n_panels*sizeof(char*));
+ msk->n_masks = img->det->n_panels;
+ for ( i=0; i<img->det->n_panels; i++) {
+
+ struct panel p;
+ int iss, ifs;
+
+ p = img->det->panels[i];
+
+ msk->masks[i] = (char *)calloc(p.w*p.h,sizeof(char));
+
+ for ( iss=0 ; iss<p.h ; iss++ ) {
+ for ( ifs=0 ; ifs<p.w ; ifs++ ) {
+
+ int idx;
+
+ idx = ifs + iss*p.w;
+
+ if ( rmps->r_maps[i][idx] < max_res
+ && rmps->r_maps[i][idx] > min_res ) {
+
+ if (! ( ( img->bad != NULL )
+ && ( img->bad[i] != NULL )
+ && ( img->bad[i][idx] != 0 ) ) ) {
+ msk->masks[i][idx] = 1;
+ }
+
+ }
+
+ }
+ }
+ }
+ return msk;
+}
+
+
+static void free_peakfinder_mask(struct peakfinder_mask * pfmask)
+{
+ int i;
+
+ for ( i=0 ; i<pfmask->n_masks ; i++ ) {
+ free(pfmask->masks[i]);
+ }
+ free(pfmask->masks);
+ free(pfmask);
+}
+
+
+static int compute_num_radial_bins(int num_panels, int *w, int *h,
+ float **r_maps)
+{
+
+ float max_r;
+ int max_r_int;
+ int m;
+
+ max_r = -1e9;
+
+ for ( m=0 ; m<num_panels ; m++ ) {
+
+ int ifs, iss;
+ int pidx;
+
+ for ( iss=0 ; iss<h[m] ; iss++ ) {
+ for ( ifs=0 ; ifs<w[m] ; ifs++ ) {
+ pidx = iss * w[m] + ifs;
+ if ( r_maps[m][pidx] > max_r ) {
+ max_r = r_maps[m][pidx];
+ }
+ }
+ }
+ }
+
+ max_r_int = (int)ceil(max_r) + 1;
+
+ return max_r_int;
+}
+
+
+static struct peakfinder_panel_data *allocate_panel_data(int num_panels)
+{
+
+ struct peakfinder_panel_data *pfdata;
+
+
+ pfdata = (struct peakfinder_panel_data *)malloc(
+ sizeof(struct peakfinder_panel_data));
+ if ( pfdata == NULL ) {
+ return NULL;
+ }
+
+ pfdata->panel_h = (int *)malloc(num_panels*sizeof(int));
+ if ( pfdata->panel_h == NULL ) {
+ free(pfdata);
+ return NULL;
+ }
+
+ pfdata->panel_w = (int *)malloc(num_panels*sizeof(int));
+ if ( pfdata->panel_w == NULL ) {
+ free(pfdata->panel_h);
+ free(pfdata);
+ return NULL;
+ }
+
+ pfdata->panel_data = (float **)malloc(num_panels*sizeof(float*));
+ if ( pfdata->panel_data == NULL ) {
+ free(pfdata->panel_w);
+ free(pfdata->panel_h);
+ free(pfdata);
+ return NULL;
+ }
+
+ pfdata->num_panels = num_panels;
+
+ return pfdata;
+}
+
+
+static void free_panel_data(struct peakfinder_panel_data *pfdata)
+{
+ free(pfdata->panel_data);
+ free(pfdata->panel_w);
+ free(pfdata->panel_h);
+ free(pfdata);
+}
+
+
+static struct radial_stats *allocate_radial_stats(int num_rad_bins)
+{
+ struct radial_stats *rstats;
+
+ rstats = (struct radial_stats *)malloc(sizeof(struct radial_stats));
+ if ( rstats == NULL ) {
+ return NULL;
+ }
+
+ rstats->roffset = (float *)malloc(num_rad_bins*sizeof(float));
+ if ( rstats->roffset == NULL ) {
+ free(rstats);
+ return NULL;
+ }
+
+ rstats->rthreshold = (float *)malloc(num_rad_bins*sizeof(float));
+ if ( rstats->rthreshold == NULL ) {
+ free(rstats);
+ free(rstats->roffset);
+ return NULL;
+ }
+
+ rstats->rsigma = (float *)malloc(num_rad_bins*sizeof(float));
+ if ( rstats->rsigma == NULL ) {
+ free(rstats);
+ free(rstats->roffset);
+ free(rstats->rthreshold);
+ return NULL;
+ }
+
+ rstats->rcount = (int *)malloc(num_rad_bins*sizeof(int));
+ if ( rstats->rcount == NULL ) {
+ free(rstats);
+ free(rstats->roffset);
+ free(rstats->rthreshold);
+ free(rstats->rsigma);
+ return NULL;
+ }
+
+ rstats->n_rad_bins = num_rad_bins;
+
+ return rstats;
+}
+
+
+static void free_radial_stats(struct radial_stats *rstats)
+{
+ free(rstats->roffset);
+ free(rstats->rthreshold);
+ free(rstats->rsigma);
+ free(rstats->rcount);
+ free(rstats);
+}
+
+
+static void fill_radial_bins(float *data,
+ int w,
+ int h,
+ float *r_map,
+ char *mask,
+ float *rthreshold,
+ float *roffset,
+ float *rsigma,
+ int *rcount)
+{
+ int iss, ifs;
+ int pidx;
+
+ int curr_r;
+ float value;
+
+ for ( iss = 0; iss<h ; iss++ ) {
+
+ for ( ifs = 0; ifs<w ; ifs++ ) {
+
+ pidx = iss * w + ifs;
+
+ if ( mask[pidx] != 0 ) {
+
+ curr_r = (int)rint(r_map[pidx]);
+
+ value = data[pidx];
+
+ if ( value < rthreshold[curr_r ] ) {
+
+ update_radial_stats(roffset,
+ rsigma,
+ rcount,
+ value,
+ curr_r);
+ }
+ }
+ }
+ }
+}
+
+
+static void compute_radial_stats(float *rthreshold,
+ float *roffset,
+ float *rsigma,
+ int *rcount,
+ int num_rad_bins,
+ float min_snr,
+ float acd_threshold)
+{
+
+ int ri;
+ float this_offset, this_sigma;
+
+ for ( ri=0 ; ri<num_rad_bins ; ri++ ) {
+
+ if ( rcount[ri] == 0 ) {
+ roffset[ri] = 0;
+ rsigma[ri] = 0;
+ rthreshold[ri] = 1e9;
+ } else {
+ this_offset = roffset[ri]/rcount[ri];
+
+ this_sigma = compute_r_sigma(rsigma,
+ rcount,
+ roffset,
+ ri);
+
+ roffset[ri] = this_offset;
+ rsigma[ri] = this_sigma;
+
+ rthreshold[ri] = roffset[ri] +
+ min_snr*rsigma[ri];
+
+ if ( rthreshold[ri] < acd_threshold ) {
+ rthreshold[ri] = acd_threshold;
+ }
+ }
+ }
+
+}
+
+
+struct peakfinder_peak_data *allocate_peak_data(int max_num_peaks)
+{
+ struct peakfinder_peak_data *pkdata;
+
+ pkdata = (struct peakfinder_peak_data*)malloc(
+ sizeof(struct peakfinder_peak_data));
+ if ( pkdata == NULL ) {
+ return NULL;
+ }
+
+ pkdata->npix = (int *)malloc(max_num_peaks*sizeof(int));
+ if ( pkdata->npix == NULL ) {
+ free(pkdata);
+ free(pkdata->npix);
+ return NULL;
+ }
+
+ pkdata->com_fs = (float *)malloc(max_num_peaks*sizeof(float));
+ if ( pkdata->com_fs == NULL ) {
+ free(pkdata->npix);
+ free(pkdata);
+ return NULL;
+ }
+
+ pkdata->com_ss = (float *)malloc(max_num_peaks*sizeof(float));
+ if ( pkdata->com_ss == NULL ) {
+ free(pkdata->npix);
+ free(pkdata->com_fs);
+ free(pkdata);
+ return NULL;
+ }
+
+ pkdata->com_index = (int *)malloc(max_num_peaks*sizeof(int));
+ if ( pkdata->com_ss == NULL ) {
+ free(pkdata->npix);
+ free(pkdata->com_fs);
+ free(pkdata->com_ss);
+ free(pkdata);
+ return NULL;
+ }
+
+
+ pkdata->tot_i = (float *)malloc(max_num_peaks*sizeof(float));
+ if ( pkdata->tot_i == NULL ) {
+ free(pkdata->npix);
+ free(pkdata->com_fs);
+ free(pkdata->com_ss);
+ free(pkdata->com_index);
+ free(pkdata);
+ return NULL;
+ }
+
+ pkdata->max_i = (float *)malloc(max_num_peaks*sizeof(float));
+ if ( pkdata->max_i == NULL ) {
+ free(pkdata->npix);
+ free(pkdata->com_fs);
+ free(pkdata->com_ss);
+ free(pkdata->com_index);
+ free(pkdata->tot_i);
+ free(pkdata);
+ return NULL;
+ }
+
+ pkdata->sigma = (float *)malloc(max_num_peaks*sizeof(float));
+ if ( pkdata->sigma == NULL ) {
+ free(pkdata->npix);
+ free(pkdata->com_fs);
+ free(pkdata->com_ss);
+ free(pkdata->com_index);
+ free(pkdata->tot_i);
+ free(pkdata->max_i);
+ free(pkdata);
+ return NULL;
+ }
+
+ pkdata->snr = (float *)malloc(max_num_peaks*sizeof(float));
+ if ( pkdata->snr == NULL ) {
+ free(pkdata->npix);
+ free(pkdata->com_fs);
+ free(pkdata->com_ss);
+ free(pkdata->com_index);
+ free(pkdata->tot_i);
+ free(pkdata->max_i);
+ free(pkdata->sigma);
+ free(pkdata);
+ return NULL;
+ }
+
+ return pkdata;
+}
+
+
+static void free_peak_data(struct peakfinder_peak_data *pkdata)
+{
+ free(pkdata->npix);
+ free(pkdata->com_fs);
+ free(pkdata->com_ss);
+ free(pkdata->com_index);
+ free(pkdata->tot_i);
+ free(pkdata->max_i);
+ free(pkdata->sigma);
+ free(pkdata->snr);
+ free(pkdata);
+}
+
+
+static struct peakfinder_intern_data *allocate_peakfinder_intern_data(
+ int data_size, int max_pix_count)
+{
+
+ struct peakfinder_intern_data *intern_data;
+
+ intern_data = (struct peakfinder_intern_data *)malloc(
+ sizeof(struct peakfinder_intern_data));
+ if ( intern_data == NULL ) {
+ return NULL;
+ }
+
+ intern_data->pix_in_peak_map =(char *)calloc(data_size, sizeof(char));
+ if ( intern_data->pix_in_peak_map == NULL ) {
+ free(intern_data);
+ return NULL;
+ }
+
+ intern_data->infs =(int *)calloc(data_size, sizeof(int));
+ if ( intern_data->infs == NULL ) {
+ free(intern_data->pix_in_peak_map);
+ free(intern_data);
+ return NULL;
+ }
+
+ intern_data->inss =(int *)calloc(data_size, sizeof(int));
+ if ( intern_data->inss == NULL ) {
+ free(intern_data->pix_in_peak_map);
+ free(intern_data->infs);
+ free(intern_data);
+ return NULL;
+ }
+
+ intern_data->peak_pixels =(int *)calloc(max_pix_count, sizeof(int));
+ if ( intern_data->peak_pixels == NULL ) {
+ free(intern_data->pix_in_peak_map);
+ free(intern_data->infs);
+ free(intern_data->inss);
+ free(intern_data);
+ return NULL;
+ }
+
+ return intern_data;
+}
+
+
+static void free_peakfinder_intern_data(struct peakfinder_intern_data *pfid)
+{
+ free(pfid->peak_pixels);
+ free(pfid->pix_in_peak_map);
+ free(pfid->infs);
+ free(pfid->inss);
+ free(pfid);
+}
+
+
+static void peak_search(int p, struct peakfinder_intern_data *pfinter,
+ float *copy, char *mask, float *r_map,
+ float *rthreshold, float *roffset,
+ int *num_pix_in_peak, int asic_size_fs,
+ int asic_size_ss, int aifs, int aiss,
+ int num_pix_fs, float *sum_com_fs,
+ float *sum_com_ss, float *sum_i, int max_pix_count)
+{
+
+ int k, pi;
+ int curr_radius;
+ float curr_threshold;
+ int curr_fs;
+ int curr_ss;
+ float curr_i;
+
+ int search_fs[9] = { 0, -1, 0, 1, -1, 1, -1, 0, 1 };
+ int search_ss[9] = { 0, -1, -1, -1, 0, 0, 1, 1, 1 };
+ int search_n = 9;
+
+ for ( k=0; k<search_n; k++ ) {
+
+ if ( (pfinter->infs[p] + search_fs[k]) < 0 )
+ continue;
+ if ( (pfinter->infs[p] + search_fs[k]) >= asic_size_fs )
+ continue;
+ if ( (pfinter->inss[p] + search_ss[k]) < 0 )
+ continue;
+ if ( (pfinter->inss[p] + search_ss[k]) >= asic_size_ss )
+ continue;
+
+ curr_fs = pfinter->infs[p] + search_fs[k] + aifs * asic_size_fs;
+ curr_ss = pfinter->inss[p] + search_ss[k] + aiss * asic_size_ss;
+ pi = curr_fs + curr_ss * num_pix_fs;
+
+ curr_radius = (int)rint(r_map[pi]);
+ curr_threshold = rthreshold[curr_radius];
+
+ if ( copy[pi] > curr_threshold
+ && pfinter->pix_in_peak_map[pi] == 0
+ && mask[pi] != 0 )
+ {
+
+
+ curr_i = copy[pi] - roffset[curr_radius];
+
+ *sum_i += curr_i;
+ *sum_com_fs += curr_i * ((float)curr_fs);
+ *sum_com_ss += curr_i * ((float)curr_ss);
+
+ pfinter->inss[*num_pix_in_peak] = pfinter->inss[p] +
+ search_ss[k];
+ pfinter->infs[*num_pix_in_peak] = pfinter->infs[p] +
+ search_fs[k];
+
+ pfinter->pix_in_peak_map[pi] = 1;
+ if ( *num_pix_in_peak < max_pix_count ) {
+ pfinter->peak_pixels[*num_pix_in_peak] = pi;
+ }
+ *num_pix_in_peak = *num_pix_in_peak+1;
+ }
+ }
+}
+
+
+static void search_in_ring(int ring_width, int com_fs_int, int com_ss_int,
+ float *copy, float *r_map,
+ float *rthreshold, float *roffset,
+ char *pix_in_peak_map, char *mask, int asic_size_fs,
+ int asic_size_ss, int aifs, int aiss,
+ int num_pix_fs,float *local_sigma,
+ float *local_offset, float *background_max_i,
+ int com_idx, int local_bg_radius)
+{
+ int ssj, fsi;
+ float pix_radius;
+ int curr_fs, curr_ss;
+ int pi;
+ int curr_radius;
+ float curr_threshold;
+ float curr_i;
+
+ int np_sigma;
+ int np_counted;
+ int local_radius;
+
+ float sum_i;
+ float sum_i_squared;
+
+ ring_width = 2 * local_bg_radius;
+
+ sum_i = 0;
+ sum_i_squared = 0;
+ np_sigma = 0;
+ np_counted = 0;
+ local_radius = 0;
+
+ for ( ssj = -ring_width ; ssj<ring_width ; ssj++ ) {
+ for ( fsi = -ring_width ; fsi<ring_width ; fsi++ ) {
+
+ if ( (com_fs_int + fsi) < 0 )
+ continue;
+ if ( (com_fs_int + fsi) >= asic_size_fs )
+ continue;
+ if ( (com_ss_int + ssj) < 0 )
+ continue;
+ if ( (com_ss_int + ssj) >= asic_size_ss )
+ continue;
+
+ pix_radius = sqrt(fsi * fsi + ssj * ssj);
+ if ( pix_radius>ring_width )
+ continue;
+
+ curr_fs = com_fs_int +fsi + aifs * asic_size_fs;
+ curr_ss = com_ss_int +ssj + aiss * asic_size_ss;
+ pi = curr_fs + curr_ss * num_pix_fs;
+
+ curr_radius = rint(r_map[pi]);
+ curr_threshold = rthreshold[curr_radius];
+ curr_i = copy[pi];
+
+ if ( copy[pi] < curr_threshold
+ && pix_in_peak_map[pi] == 0
+ && mask[pi] != 0 ) {
+
+ np_sigma++;
+ sum_i += curr_i;
+ sum_i_squared += (curr_i * curr_i);
+
+ if ( curr_i > *background_max_i ) {
+ *background_max_i = curr_i;
+ }
+ }
+ np_counted += 1;
+ }
+ }
+
+ if ( np_sigma != 0 ) {
+ *local_offset = sum_i / np_sigma;
+ *local_sigma = sqrt(sum_i_squared / np_sigma -
+ ((sum_i / np_sigma) * (sum_i / np_sigma)));
+ } else {
+
+ local_radius = rint(r_map[(int)rint(com_idx)]);
+ *local_offset = roffset[local_radius];
+ *local_sigma = 0.01;
+ }
+}
+
+
+static void process_panel(int asic_size_fs, int asic_size_ss, int num_pix_fs,
+ int aiss, int aifs, float *rthreshold,
+ float *roffset, int *peak_count,
+ float *copy, struct peakfinder_intern_data *pfinter,
+ float *r_map, char *mask, int *npix, float *com_fs,
+ float *com_ss, int *com_index, float *tot_i,
+ float *max_i, float *sigma, float *snr,
+ int min_pix_count, int max_pix_count,
+ int local_bg_radius, float min_snr, int max_n_peaks)
+{
+ int pxss, pxfs;
+ int num_pix_in_peak;
+
+ for ( pxss=1 ; pxss<asic_size_ss-1 ; pxss++ ) {
+ for ( pxfs=1 ; pxfs<asic_size_fs-1 ; pxfs++ ) {
+
+ float curr_thresh;
+ int pxidx;
+ int curr_rad;
+
+ pxidx = (pxss + aiss * asic_size_ss) *
+ num_pix_fs + pxfs +
+ aifs * asic_size_fs;
+
+ curr_rad = (int)rint(r_map[pxidx]);
+ curr_thresh = rthreshold[curr_rad];
+
+ if ( copy[pxidx] > curr_thresh
+ && pfinter->pix_in_peak_map[pxidx] == 0 ) {
+
+ float sum_com_fs, sum_com_ss;
+ float sum_i;
+ float peak_com_fs, peak_com_ss;
+ float peak_com_fs_int, peak_com_ss_int;
+ float peak_tot_i, pk_tot_i_raw;
+ float peak_max_i, pk_max_i_raw;
+ float peak_snr;
+ float local_sigma, local_offset;
+ float background_max_i;
+ float f_background_thresh;
+ int lt_num_pix_in_pk;
+ int ring_width;
+ int peak_idx;
+ int com_idx;
+ int p;
+
+ pfinter->infs[0] = pxfs;
+ pfinter->inss[0] = pxss;
+ pfinter->peak_pixels[0] = pxidx;
+ num_pix_in_peak = 1;
+
+ sum_i = 0;
+ sum_com_fs = 0;
+ sum_com_ss = 0;
+
+ do {
+ lt_num_pix_in_pk = num_pix_in_peak;
+
+ for ( p=0; p<num_pix_in_peak; p++ ) {
+ peak_search(p,
+ pfinter, copy, mask,
+ r_map,
+ rthreshold,
+ roffset,
+ &num_pix_in_peak,
+ asic_size_fs,
+ asic_size_ss,
+ aifs, aiss,
+ num_pix_fs,
+ &sum_com_fs,
+ &sum_com_ss,
+ &sum_i,
+ max_pix_count);
+ }
+
+ } while ( lt_num_pix_in_pk != num_pix_in_peak );
+
+ if ( num_pix_in_peak < min_pix_count
+ || num_pix_in_peak > max_pix_count) {
+ continue;
+ }
+
+ peak_com_fs = sum_com_fs / fabs(sum_i);
+ peak_com_ss = sum_com_ss / fabs(sum_i);
+
+ com_idx = rint(peak_com_fs) +
+ rint(peak_com_ss) * num_pix_fs;
+
+ peak_com_fs_int = (int)rint(peak_com_fs) -
+ aifs * asic_size_fs;
+ peak_com_ss_int = (int)rint(peak_com_ss) -
+ aiss * asic_size_ss;
+
+ local_sigma = 0.0;
+ local_offset = 0.0;
+ background_max_i = 0.0;
+
+ ring_width = 2 * local_bg_radius;
+
+ search_in_ring(ring_width, peak_com_fs_int,
+ peak_com_ss_int,
+ copy, r_map, rthreshold,
+ roffset,
+ pfinter->pix_in_peak_map,
+ mask, asic_size_fs,
+ asic_size_ss,
+ aifs, aiss,
+ num_pix_fs,
+ &local_sigma,
+ &local_offset,
+ &background_max_i,
+ com_idx, local_bg_radius);
+
+ peak_tot_i = 0;
+ pk_tot_i_raw = 0;
+ peak_max_i = 0;
+ pk_max_i_raw = 0;
+ sum_com_fs = 0;
+ sum_com_ss = 0;
+
+ for ( peak_idx = 1 ;
+ peak_idx < num_pix_in_peak
+ && peak_idx <= max_pix_count ;
+ peak_idx++ ) {
+
+ int curr_idx;
+ float curr_i;
+ float curr_i_raw;
+ int curr_fs, curr_ss;
+
+ // BUG HERE, I THINK. PEAK_PIXELS
+ // HAS SIZE MAX_PIX_COUNT, BUT
+ // IN THE FOLLOWING LINE PEAK_IDX
+ // CAN HAVE VALUE EXACTLY MAX_PEAK_COUNT
+ // (SEE THE FOR LOOP ABOVE)
+ curr_idx =
+ pfinter->peak_pixels[peak_idx];
+
+ curr_i_raw = copy[curr_idx];
+ curr_i = curr_i_raw - local_offset;
+
+ peak_tot_i += curr_i;
+ pk_tot_i_raw += curr_i_raw;
+
+ curr_fs = curr_idx % asic_size_fs;
+ curr_ss = curr_idx / asic_size_fs;
+ sum_com_fs += curr_i * ((float)curr_fs);
+ sum_com_ss += curr_i * ((float)curr_ss);
+
+ if ( curr_i_raw > pk_max_i_raw )
+ pk_max_i_raw = curr_i_raw;
+ if ( curr_i > peak_max_i )
+ peak_max_i = curr_i;
+ }
+
+
+ peak_com_fs = sum_com_fs / fabs(peak_tot_i);
+ peak_com_ss = sum_com_ss / fabs(peak_tot_i);
+
+ peak_snr = peak_tot_i / local_sigma;
+
+ if (peak_snr < min_snr) {
+ continue;
+ }
+
+ f_background_thresh = 1;
+ f_background_thresh *=
+ background_max_i - local_offset;
+ if (peak_max_i < f_background_thresh) {
+ continue;
+ }
+
+ if ( num_pix_in_peak >= min_pix_count
+ && num_pix_in_peak <= max_pix_count ) {
+
+ int peak_com_idx;
+
+ if ( peak_tot_i == 0 ) {
+ continue;
+ }
+
+ peak_com_idx = rint(peak_com_fs) +
+ rint(peak_com_ss) *
+ asic_size_fs;
+
+ if ( *peak_count < max_n_peaks ) {
+
+ int pidx;
+ pidx = *peak_count;
+
+ npix[pidx] = num_pix_in_peak;
+ com_fs[pidx] = peak_com_fs;
+ com_ss[pidx] = peak_com_ss;
+ com_index[pidx] = peak_com_idx;
+ tot_i[pidx] = peak_tot_i;
+ max_i[pidx] = peak_max_i;
+ sigma[pidx] = local_sigma;
+ snr[pidx] = peak_snr;
+ *peak_count = *peak_count + 1;
+ } else {
+ *peak_count = *peak_count + 1;
+ }
+ }
+ }
+ }
+ }
+}
+
+
+static int peakfinder8_base(float *roffset, float *rthreshold,
+ float *data, char *mask, float *r_map,
+ int asic_size_fs, int num_asics_fs,
+ int asic_size_ss, int num_asics_ss,
+ int max_n_peaks, int *num_found_peaks,
+ int *npix, float *com_fs,
+ float *com_ss, int *com_index, float *tot_i,
+ float *max_i, float *sigma, float *snr,
+ int min_pix_count, int max_pix_count,
+ int local_bg_radius, float min_snr)
+{
+ int num_pix_fs, num_pix_ss, num_pix_tot;
+ int i, aifs, aiss;
+ int peak_count;
+ float *copy;
+ struct peakfinder_intern_data *pfinter;
+
+ num_pix_fs = asic_size_fs * num_asics_fs;
+ num_pix_ss = asic_size_ss * num_asics_ss;
+ num_pix_tot = num_pix_fs * num_pix_ss;
+
+ copy = (float *)calloc(num_pix_tot, sizeof(float));
+ if ( copy == NULL ) {
+ return 1;
+ }
+
+ memcpy(copy, data, num_pix_tot*sizeof(float));
+
+ for (i = 0; i < num_pix_tot; i++) {
+ copy[i] *= mask[i];
+ }
+
+ pfinter = allocate_peakfinder_intern_data(num_pix_tot, max_pix_count);
+ if ( pfinter == NULL ) {
+ free(copy);
+ return 1;
+ }
+
+ peak_count = 0;
+
+ for ( aiss=0 ; aiss<num_asics_ss ; aiss++ ) {
+ for ( aifs=0 ; aifs<num_asics_fs ; aifs++ ) {
+
+ process_panel(asic_size_fs, asic_size_ss, num_pix_fs,
+ aiss, aifs, rthreshold, roffset,
+ &peak_count, copy, pfinter, r_map, mask,
+ npix, com_fs, com_ss, com_index, tot_i,
+ max_i, sigma, snr, min_pix_count,
+ max_pix_count, local_bg_radius, min_snr,
+ max_n_peaks);
+ }
+ }
+ *num_found_peaks = peak_count;
+
+ free_peakfinder_intern_data(pfinter);
+ free(copy);
+
+ return 0;
+}
+
+
+int peakfinder8(struct image *img, int max_n_peaks,
+ float threshold, float min_snr,
+ int min_pix_count, int max_pix_count,
+ int local_bg_radius, int min_res,
+ int max_res, int use_saturated)
+{
+ struct radius_maps *rmaps;
+ struct peakfinder_mask *pfmask;
+ struct peakfinder_panel_data *pfdata;
+ struct radial_stats *rstats;
+ struct peakfinder_peak_data *pkdata;
+ int num_rad_bins;
+ int pi;
+ int i, it_counter;
+ int num_found_peaks;
+ int remaining_max_num_peaks;
+ int iterations;
+
+ iterations = 5;
+
+ if ( img-> det == NULL) {
+ return 1;
+ }
+
+ rmaps = compute_radius_maps(img->det);
+ if ( rmaps == NULL ) {
+ return 1;
+ }
+
+ pfmask = create_peakfinder_mask(img, rmaps, min_res, max_res);
+ if ( pfmask == NULL ) {
+ free_radius_maps(rmaps);
+ return 1;
+ }
+
+ pfdata = allocate_panel_data(img->det->n_panels);
+ if ( pfdata == NULL) {
+ free_radius_maps(rmaps);
+ free_peakfinder_mask(pfmask);
+ return 1;
+ }
+
+ for ( pi=0 ; pi<img->det->n_panels ; pi++ ) {
+ pfdata->panel_h[pi] = img->det->panels[pi].h;
+ pfdata->panel_w[pi] = img->det->panels[pi].w;
+ pfdata->panel_data[pi] = img->dp[pi];
+ pfdata->num_panels = img->det->n_panels;
+ }
+
+ num_rad_bins = compute_num_radial_bins(img->det->n_panels,
+ pfdata->panel_w,
+ pfdata->panel_h,
+ rmaps->r_maps);
+
+ rstats = allocate_radial_stats(num_rad_bins);
+ if ( rstats == NULL ) {
+ free_radius_maps(rmaps);
+ free_peakfinder_mask(pfmask);
+ free_panel_data(pfdata);
+ return 1;
+ }
+
+ for ( i=0 ; i<rstats->n_rad_bins ; i++) {
+ rstats->rthreshold[i] = 1e9;
+ }
+
+ for ( it_counter=0 ; it_counter<iterations ; it_counter++ ) {
+
+ for ( i=0; i<num_rad_bins; i++ ) {
+ rstats->roffset[i] = 0;
+ rstats->rsigma[i] = 0;
+ rstats->rcount[i] = 0;
+ }
+
+ for ( pi=0 ; pi<pfdata->num_panels ; pi++ ) {
+
+ fill_radial_bins(pfdata->panel_data[pi],
+ pfdata->panel_w[pi],
+ pfdata->panel_h[pi],
+ rmaps->r_maps[pi],
+ pfmask->masks[pi],
+ rstats->rthreshold,
+ rstats->roffset,
+ rstats->rsigma,
+ rstats->rcount);
+
+ }
+
+ compute_radial_stats(rstats->rthreshold,
+ rstats->roffset,
+ rstats->rsigma,
+ rstats->rcount,
+ num_rad_bins,
+ min_snr,
+ threshold);
+
+ }
+
+ pkdata = allocate_peak_data(max_n_peaks);
+ if ( pkdata == NULL ) {
+ free_radius_maps(rmaps);
+ free_peakfinder_mask(pfmask);
+ free_panel_data(pfdata);
+ free_radial_stats(rstats);
+ return 1;
+ }
+
+ remaining_max_num_peaks = max_n_peaks;
+
+ for ( pi=0 ; pi<img->det->n_panels ; pi++) {
+
+ int peaks_to_add;
+ int pki;
+ int ret;
+
+ num_found_peaks = 0;
+
+ if ( img->det->panels[pi].no_index ) {
+ continue;
+ }
+
+ ret = peakfinder8_base(rstats->roffset,
+ rstats->rthreshold,
+ pfdata->panel_data[pi],
+ pfmask->masks[pi],
+ rmaps->r_maps[pi],
+ pfdata->panel_w[pi], 1,
+ pfdata->panel_h[pi], 1,
+ max_n_peaks,
+ &num_found_peaks,
+ pkdata->npix,
+ pkdata->com_fs,
+ pkdata->com_ss,
+ pkdata->com_index,
+ pkdata->tot_i,
+ pkdata->max_i,
+ pkdata->sigma,
+ pkdata->snr,
+ min_pix_count,
+ max_pix_count,
+ local_bg_radius,
+ min_snr);
+
+ if ( ret != 0 ) {
+ free_radius_maps(rmaps);
+ free_peakfinder_mask(pfmask);
+ free_panel_data(pfdata);
+ free_radial_stats(rstats);
+ return 1;
+ }
+
+ peaks_to_add = num_found_peaks;
+
+ if ( num_found_peaks > remaining_max_num_peaks ) {
+ peaks_to_add = remaining_max_num_peaks;
+ }
+
+ remaining_max_num_peaks -= peaks_to_add;
+
+ for ( pki=0 ; pki<peaks_to_add ; pki++ ) {
+
+ struct panel *p;
+
+ p = &img->det->panels[pi];
+
+ img->num_peaks += 1;
+ if ( pkdata->max_i[pki] > p->max_adu ) {
+ img->num_saturated_peaks++;
+ if ( !use_saturated ) {
+ continue;
+ }
+ }
+
+ image_add_feature(img->features,
+ pkdata->com_fs[pki],
+ pkdata->com_ss[pki],
+ p,
+ img,
+ pkdata->tot_i[pki],
+ NULL);
+ }
+ }
+
+ free_radius_maps(rmaps);
+ free_peakfinder_mask(pfmask);
+ free_panel_data(pfdata);
+ free_radial_stats(rstats);
+ free_peak_data(pkdata);
+ return 0;
+}
diff --git a/libcrystfel/src/peakfinder8.h b/libcrystfel/src/peakfinder8.h
new file mode 100644
index 00000000..483eebdf
--- /dev/null
+++ b/libcrystfel/src/peakfinder8.h
@@ -0,0 +1,50 @@
+/*
+ * peakfinder8.h
+ *
+ * The peakfinder8 algorithm
+ *
+ * Copyright © 2012-2017 Deutsches Elektronen-Synchrotron DESY,
+ * a research centre of the Helmholtz Association.
+ *
+ * Authors:
+ * 2017 Valerio Mariani <valerio.mariani@desy.de>
+ * 2017 Anton Barty <anton.barty@desy.de>
+ * 2017 Oleksandr Yefanov <oleksandr.yefanov@desy.de>
+ *
+ * This file is part of CrystFEL.
+ *
+ * CrystFEL is free software: you can redistribute it and/or modify
+ * it under the terms of the GNU General Public License as published by
+ * the Free Software Foundation, either version 3 of the License, or
+ * (at your option) any later version.
+ *
+ * CrystFEL is distributed in the hope that it will be useful,
+ * but WITHOUT ANY WARRANTY; without even the implied warranty of
+ * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
+ * GNU General Public License for more details.
+ *
+ * You should have received a copy of the GNU General Public License
+ * along with CrystFEL. If not, see <http://www.gnu.org/licenses/>.
+ *
+ */
+
+#ifndef PEAKFINDER8_H
+#define PEAKFINDER8_H
+
+#include "image.h"
+
+#ifdef __cplusplus
+extern "C" {
+#endif
+
+extern int peakfinder8(struct image *img, int max_n_peaks,
+ float threshold, float min_snr,
+ int mix_pix_count, int max_pix_count,
+ int local_bg_radius, int min_res,
+ int max_res, int use_saturated);
+
+#ifdef __cplusplus
+}
+#endif
+
+#endif // PEAKFINDER8_H
diff --git a/libcrystfel/src/peaks.c b/libcrystfel/src/peaks.c
index cb2a9f5a..28c79538 100644
--- a/libcrystfel/src/peaks.c
+++ b/libcrystfel/src/peaks.c
@@ -3,7 +3,7 @@
*
* Peak search and other image analysis
*
- * Copyright © 2012-2016 Deutsches Elektronen-Synchrotron DESY,
+ * Copyright © 2012-2017 Deutsches Elektronen-Synchrotron DESY,
* a research centre of the Helmholtz Association.
* Copyright © 2012 Richard Kirian
*
@@ -12,6 +12,7 @@
* 2012 Kenneth Beyerlein <kenneth.beyerlein@desy.de>
* 2011 Andrew Martin <andrew.martin@desy.de>
* 2011 Richard Kirian
+ * 2017 Valerio Mariani <valerio.mariani@desy.de>
*
* This file is part of CrystFEL.
*
@@ -52,6 +53,7 @@
#include "reflist-utils.h"
#include "cell-utils.h"
#include "geometry.h"
+#include "peakfinder8.h"
static int cull_peaks_in_panel(struct image *image, struct panel *p)
@@ -517,8 +519,8 @@ static void search_peaks_in_panel(struct image *image, float threshold,
void search_peaks(struct image *image, float threshold, float min_gradient,
- float min_snr, double ir_inn, double ir_mid, double ir_out,
- int use_saturated)
+ float min_snr, double ir_inn, double ir_mid,
+ double ir_out, int use_saturated)
{
int i;
@@ -541,6 +543,26 @@ void search_peaks(struct image *image, float threshold, float min_gradient,
}
+int search_peaks_peakfinder8(struct image *image, int max_n_peaks,
+ float threshold, float min_snr,
+ int min_pix_count, int max_pix_count,
+ int local_bg_radius, int min_res,
+ int max_res, int use_saturated)
+{
+ if ( image->features != NULL ) {
+ image_feature_list_free(image->features);
+ }
+ image->features = image_feature_list_new();
+ image->num_peaks = 0;
+ image->num_saturated_peaks = 0;
+
+ return peakfinder8(image, max_n_peaks, threshold, min_snr,
+ min_pix_count, max_pix_count,
+ local_bg_radius, min_res,
+ max_res, use_saturated);
+}
+
+
int peak_sanity_check(struct image *image, Crystal **crystals, int n_cryst)
{
int n_feat = 0;
diff --git a/libcrystfel/src/peaks.h b/libcrystfel/src/peaks.h
index ba724419..a5095127 100644
--- a/libcrystfel/src/peaks.h
+++ b/libcrystfel/src/peaks.h
@@ -3,11 +3,12 @@
*
* Peak search and other image analysis
*
- * Copyright © 2012-2015 Deutsches Elektronen-Synchrotron DESY,
+ * Copyright © 2012-2017 Deutsches Elektronen-Synchrotron DESY,
* a research centre of the Helmholtz Association.
*
* Authors:
* 2010-2015 Thomas White <taw@physics.org>
+ * 2017 Valerio Mariani <valerio.mariani@desy.de>
*
* This file is part of CrystFEL.
*
@@ -45,9 +46,14 @@ extern "C" {
extern int *make_BgMask(struct image *image, struct panel *p, double ir_inn);
extern void search_peaks(struct image *image, float threshold,
- float min_gradient, float min_snr,
- double ir_inn, double ir_mid, double ir_out,
- int use_saturated);
+ float min_gradient, float min_snr, double ir_inn,
+ double ir_mid, double ir_out, int use_saturated);
+
+extern int search_peaks_peakfinder8(struct image *image, int max_n_peaks,
+ float threshold, float min_snr,
+ int mix_pix_count, int max_pix_count,
+ int local_bg_radius, int min_res,
+ int max_res, int use_saturated);
extern int peak_sanity_check(struct image *image, Crystal **crystals,
int n_cryst);