diff options
Diffstat (limited to 'src/post-refinement.h')
| -rw-r--r-- | src/post-refinement.h | 20 |
1 files changed, 15 insertions, 5 deletions
diff --git a/src/post-refinement.h b/src/post-refinement.h index 7f395013..71a6d7f3 100644 --- a/src/post-refinement.h +++ b/src/post-refinement.h @@ -3,11 +3,11 @@ * * Post refinement * - * Copyright © 2012-2015 Deutsches Elektronen-Synchrotron DESY, + * Copyright © 2012-2018 Deutsches Elektronen-Synchrotron DESY, * a research centre of the Helmholtz Association. * * Authors: - * 2010-2015 Thomas White <taw@physics.org> + * 2010-2018 Thomas White <taw@physics.org> * * This file is part of CrystFEL. * @@ -41,6 +41,7 @@ #include "utils.h" #include "crystal.h" #include "geometry.h" +#include "symmetry.h" enum prflag @@ -51,19 +52,28 @@ enum prflag PRFLAG_EARLY = 18, PRFLAG_CC = 19, PRFLAG_BIGB = 20, + PRFLAG_SCALEBAD = 21, }; extern const char *str_prflag(enum prflag flag); extern void refine_all(Crystal **crystals, int n_crystals, - RefList *full, int nthreads, PartialityModel pmodel); + RefList *full, int nthreads, PartialityModel pmodel, + int verbose, int cycle, int no_logs, + SymOpList *sym, SymOpList *amb, int scaleflags); + +extern void write_gridscan(Crystal *cr, const RefList *full, + int cycle, int serial, int scaleflags); + +extern void write_specgraph(Crystal *crystal, const RefList *full, + signed int cycle, int serial); /* Exported so it can be poked by tests/pr_p_gradient_check */ extern double gradient(Crystal *cr, int k, Reflection *refl, PartialityModel pmodel); -extern double residual(Crystal *cr, const RefList *full, int free, - int *pn_used, const char *filename); +extern void write_test_logs(Crystal *crystal, const RefList *full, + signed int cycle, int serial); #endif /* POST_REFINEMENT_H */ |