diff options
author | Thomas White <taw@physics.org> | 2017-03-24 14:48:00 +0100 |
---|---|---|
committer | Thomas White <taw@physics.org> | 2017-03-24 14:48:00 +0100 |
commit | 1f613c288763a165b6e803d918f9fd8613996212 (patch) | |
tree | 957275219c6d87fe36cb3b6091e8dc90358aa0ae /libcrystfel | |
parent | 48f66a24733cca076b56ef5981f79ff690f7e39c (diff) | |
parent | 425619c37c3973cd354a667a61e84ccab7d81572 (diff) |
Merge branch 'valerio/peakfinder8'
Diffstat (limited to 'libcrystfel')
-rw-r--r-- | libcrystfel/Makefile.am | 6 | ||||
-rw-r--r-- | libcrystfel/src/peakfinder8.c | 1233 | ||||
-rw-r--r-- | libcrystfel/src/peakfinder8.h | 50 | ||||
-rw-r--r-- | libcrystfel/src/peaks.c | 28 | ||||
-rw-r--r-- | libcrystfel/src/peaks.h | 14 |
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); |