diff options
| author | Thomas White <taw@physics.org> | 2015-09-08 15:30:48 +0200 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2015-09-24 13:28:30 +0200 |
| commit | 63741b85b77d5a822e95318f549fe4d2392e29b8 (patch) | |
| tree | 67b3f8f1069cad6f811b0b0805589ff66b49230e /src/partialator.c | |
| parent | 950d25fda7ac78fc4f97c5b3ce12f549b6cb9995 (diff) | |
Reject big B factors before trying PR
Diffstat (limited to 'src/partialator.c')
| -rw-r--r-- | src/partialator.c | 6 |
1 files changed, 3 insertions, 3 deletions
diff --git a/src/partialator.c b/src/partialator.c index 5032296f..de08df34 100644 --- a/src/partialator.c +++ b/src/partialator.c @@ -983,7 +983,7 @@ int main(int argc, char *argv[]) full = merge_intensities(crystals, n_crystals, nthreads, pmodel, min_measurements, push_res); - check_rejection(crystals, n_crystals, full, max_B); + check_rejection(crystals, n_crystals, full); write_pgraph(full, crystals, n_crystals, 0); @@ -999,7 +999,7 @@ int main(int argc, char *argv[]) /* Refine all crystals to get the best fit */ refine_all(crystals, n_crystals, full, nthreads, pmodel, - no_scale, no_pr, + no_scale, no_pr, max_B, &init_dev, &init_free_dev, &init_log_dev, &init_free_log_dev, &final_dev, &final_free_dev, @@ -1014,7 +1014,7 @@ int main(int argc, char *argv[]) STATUS("Overall log free residual: initial = %e, final = %e\n", init_free_log_dev, final_free_log_dev); - check_rejection(crystals, n_crystals, full, max_B); + check_rejection(crystals, n_crystals, full); normalise_scales(crystals, n_crystals); /* Re-estimate all the full intensities */ |