7#ifndef BALL_NMR_EFSHIFTPROCESSOR_H
8#define BALL_NMR_EFSHIFTPROCESSOR_H
10#ifndef BALL_NMR_SHIFT_MODULE_H
14#ifndef BALL_KERNEL_EXPRESSION_H
39 static const
char* PROPERTY__EF_SHIFT;
136 virtual
bool finish()
167 std::vector<
float> epsilon1_;
171 std::vector<
float> epsilon2_;
182 bool exclude_residue_field_;
189 bool exclude_adjacent_residue_field_;
196 bool carbonyl_influences_amide_field_;
204 bool exclude_solvent_field_;
227 float charge_factor_;
234 void printParameters_();
235 void printEffectors_();
236 void printTargets_();
241 void postprocessing_();
#define BALL_CREATE(name)