Gromacs  2019-beta1
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ForceProviders Struct Reference

#include <gromacs/mdtypes/iforceprovider.h>


Evaluates forces from a collection of gmx::IForceProvider.

This class is a struct outside the gmx namespace to make it possible to forward-declare it in forcerec.h, which still needs to compile when included from the C group kernels.

Public Member Functions

void addForceProvider (gmx::IForceProvider *provider)
 Adds a provider.
bool hasForceProvider () const
 Whether there are modules added.
void calculateForces (const gmx::ForceProviderInput &forceProviderInput, gmx::ForceProviderOutput *forceProviderOutput) const
 Computes forces.

The documentation for this struct was generated from the following files: