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DisulfideAtomIndices.hh File Reference

Disulfide Atom Indices class declaration. More...

#include <core/scoring/disulfides/DisulfideAtomIndices.fwd.hh>
#include <core/types.hh>
#include <core/conformation/Residue.fwd.hh>
#include <utility/vector1_bool.hh>


class  core::scoring::disulfides::DisulfideAtomIndices
 This class is used by the *DisulfideEnergyContainer and the *DisulfidePotential classes to rapidly index into a residue that's known to form a disulfide. For the sake of computing derivatives, there are only three atoms that need to be readily available: CA, CB, and the atom which makes the disulfide bond, either SG or CEN. The DisulfideEnergyContainer is responsible for keeping the indices in one of these objects up-to-date with the residue it is meant to shadow. More...


 A class for reading in the atom type properties.

Detailed Description

Disulfide Atom Indices class declaration.

Andrew Leaver-Fay