diff options
author | Thomas White <taw@physics.org> | 2015-07-21 13:28:01 +0200 |
---|---|---|
committer | Thomas White <taw@physics.org> | 2015-07-21 14:53:10 +0200 |
commit | a59b214e1c08f4b988cc4fb2e6ef1c5d10ec363f (patch) | |
tree | 22163db5c81c8a2e23d963ca5085a81e020ead42 /libcrystfel | |
parent | e7af42c5c8b9dfb2efbc4767cb827c46e112fc98 (diff) |
Add random partiality model
Diffstat (limited to 'libcrystfel')
-rw-r--r-- | libcrystfel/src/geometry.c | 40 | ||||
-rw-r--r-- | libcrystfel/src/geometry.h | 2 |
2 files changed, 41 insertions, 1 deletions
diff --git a/libcrystfel/src/geometry.c b/libcrystfel/src/geometry.c index d8b40a16..cdd936e2 100644 --- a/libcrystfel/src/geometry.c +++ b/libcrystfel/src/geometry.c @@ -164,7 +164,42 @@ double gaussian_fraction(double rlow, double rhigh, double R) } +static double random_partiality(signed int h, signed int k, signed int l, + int serial) +{ + gsl_rng *rng = gsl_rng_alloc(gsl_rng_mt19937); + unsigned long int seed; + double p; + int i; + + gsl_rng_set(rng, serial); + for ( i=0; i<abs(h)+1; i++ ) { + seed = gsl_rng_get(rng); + } + if ( h < 0 ) seed = gsl_rng_get(rng); + gsl_rng_set(rng, seed); + + for ( i=0; i<abs(k)+1; i++ ) { + seed = gsl_rng_get(rng); + } + if ( k < 0 ) seed = gsl_rng_get(rng); + gsl_rng_set(rng, seed); + + for ( i=0; i<abs(l)+1; i++ ) { + seed = gsl_rng_get(rng); + } + if ( l < 0 ) seed = gsl_rng_get(rng); + gsl_rng_set(rng, seed); + + p = gsl_rng_uniform(rng); + gsl_rng_free(rng); + return p; +} + + static double partiality(PartialityModel pmodel, + signed int h, signed int k, signed int l, + int serial, double rlow, double rhigh, double pr) { double D = rlow - rhigh; @@ -182,6 +217,9 @@ static double partiality(PartialityModel pmodel, case PMODEL_SCGAUSSIAN: return 4.0*gaussian_fraction(rlow, rhigh, pr)*pr / (3.0*D); + case PMODEL_RANDOM: + return random_partiality(h, k, l, serial); + } } @@ -234,7 +272,7 @@ static Reflection *check_reflection(struct image *image, Crystal *cryst, && (fabs(rhigh) > pr) ) return NULL; /* Calculate partiality */ - part = partiality(pmodel, rlow, rhigh, pr); + part = partiality(pmodel, h, k, l, image->serial, rlow, rhigh, pr); if ( isnan(part) ) { ERROR("Assigning NAN partiality!\n"); diff --git a/libcrystfel/src/geometry.h b/libcrystfel/src/geometry.h index 474755b2..6b035175 100644 --- a/libcrystfel/src/geometry.h +++ b/libcrystfel/src/geometry.h @@ -49,6 +49,7 @@ extern "C" { * @PMODEL_UNITY : Set all all partialities and Lorentz factors to 1. * @PMODEL_SCSPHERE : Sphere model with source coverage factor included * @PMODEL_SCGAUSSIAN : Gaussian model with source coverage factor included + * @PMODEL_RANDOM : Randomly assigned partialities * * A %PartialityModel describes a geometrical model which can be used to * calculate spot partialities and Lorentz correction factors. @@ -58,6 +59,7 @@ typedef enum { PMODEL_UNITY, PMODEL_SCSPHERE, PMODEL_SCGAUSSIAN, + PMODEL_RANDOM, } PartialityModel; |