/* * post-refinement.h * * Post refinement * * Copyright © 2012 Deutsches Elektronen-Synchrotron DESY, * a research centre of the Helmholtz Association. * * Authors: * 2010-2012 Thomas White * * 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 . * */ #ifndef POST_REFINEMENT_H #define POST_REFINEMENT_H #ifdef HAVE_CONFIG_H #include #endif #include #include "image.h" #include "utils.h" #include "crystal.h" #include "geometry.h" /* Refineable parameters. * Don't forget to add new things to backup_crystal() et al.! */ enum { REF_ASX, REF_ASY, REF_ASZ, REF_BSX, REF_BSY, REF_BSZ, REF_CSX, REF_CSY, REF_CSZ, NUM_PARAMS, REF_DIV, REF_R, }; struct prdata { int n_filtered; }; extern struct prdata pr_refine(Crystal *cr, const RefList *full, PartialityModel pmodel); /* Exported so it can be poked by tests/pr_gradient_check */ extern double p_gradient(Crystal *cr, int k, Reflection *refl, PartialityModel pmodel); extern double l_gradient(Crystal *cr, int k, Reflection *refl, PartialityModel pmodel); #endif /* POST_REFINEMENT_H */