8 #ifndef IMPATOM_IMPROPER_SINGLETON_SCORE_H
9 #define IMPATOM_IMPROPER_SINGLETON_SCORE_H
11 #include <IMP/atom/atom_config.h>
17 IMPATOM_BEGIN_NAMESPACE
#define IMP_OBJECT_METHODS(Name)
Define the basic things needed by any Object.
Single variable function.
A more IMP-like version of the std::vector.
Contains decorators for a bond.
Class for storing model, its restraints, constraints, and particles.
Abstract class for scoring object(s) of type ParticleIndex.
#define IMP_SINGLETON_SCORE_METHODS(Name)
A smart pointer to a ref-counted Object that is a class member.
Score the improper dihedral based on a UnaryFunction,.
virtual ModelObjectsTemp do_get_inputs(Model *m, const ParticleIndexes &pis) const =0
Overload this method to specify the inputs.
#define IMP_OBJECTS(Name, PluralName)
Define the types for storing lists of object pointers.
A nullptr-initialized pointer to an IMP Object.
virtual double evaluate_index(Model *m, ParticleIndex vt, DerivativeAccumulator *da) const =0
Compute the score and the derivative if needed.
Abstract single variable functor class for score functions.
Class for adding derivatives from restraints to the model.