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authorThomas White <taw@physics.org>2015-08-31 17:22:26 +0200
committerThomas White <taw@physics.org>2015-08-31 17:22:26 +0200
commite9caa5bb6a12138b857bdd214ba7197b2f2e43f1 (patch)
tree2d22a67ad9b918fac2d5cd3c7f13dbafc0409302 /src/rejection.c
parentf64e11a71fb860ec0c7f421c359b8b5125a8c470 (diff)
partialator: Add --max-rel-B
Diffstat (limited to 'src/rejection.c')
-rw-r--r--src/rejection.c4
1 files changed, 2 insertions, 2 deletions
diff --git a/src/rejection.c b/src/rejection.c
index cea43701..ef185034 100644
--- a/src/rejection.c
+++ b/src/rejection.c
@@ -193,7 +193,7 @@ static void show_duds(Crystal **crystals, int n_crystals)
}
-void check_rejection(Crystal **crystals, int n, RefList *full)
+void check_rejection(Crystal **crystals, int n, RefList *full, double max_B)
{
int i;
int n_acc = 0;
@@ -204,7 +204,7 @@ void check_rejection(Crystal **crystals, int n, RefList *full)
for ( i=0; i<n; i++ ) {
/* Reject if B factor modulus is very large */
- if ( fabs(crystal_get_Bfac(crystals[i])) > 1e-18 ) {
+ if ( fabs(crystal_get_Bfac(crystals[i])) > max_B ) {
crystal_set_user_flag(crystals[i], PRFLAG_BIGB);
}