RDKit: TorsionAngleContribs.h File Reference

| RDKit Open-source cheminformatics and machine learning.

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TorsionAngleContribs.h File Reference
`#include <RDGeneral/export.h>`
`#include <ForceField/Contrib.h>`
`#include <vector>`

Go to the source code of this file.

## Classes
struct | ForceFields::CrystalFF::TorsionAngleContribsParams
class | ForceFields::CrystalFF::TorsionAngleContribs

## Namespaces
namespace | RDGeom
namespace | ForceFields
namespace | ForceFields::CrystalFF

## Functions
RDKIT_FORCEFIELDHELPERS_EXPORT double | ForceFields::CrystalFF::calcTorsionEnergy (const std::vector< double > &forceConstants, const std::vector< int > &signs, const double cosPhi)