RDKit: TorsionConstraint.h Source File

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UFF/TorsionConstraint.h
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1//
2// Copyright (C) 2013-2024 Paolo Tosco and other RDKit contributors
3//
4// @@ All Rights Reserved @@
5// This file is part of the RDKit.
6// The contents are covered by the terms of the BSD license
7// which is included in the file license.txt, found at the root
8// of the RDKit source tree.
9//
10#include <RDGeneral/export.h>
11#ifndef RD_UFFTORSIONCONSTRAINT_H
12#define RD_UFFTORSIONCONSTRAINT_H
13#include <ForceField/TorsionConstraint.h>
14
15namespace ForceFields {
16namespace UFF {
17 using TorsionConstraintContrib = ForceFields::TorsionConstraintContrib;
18} // namespace UFF
19} // namespace ForceFields
20#endif
TorsionConstraint.h
ForceFields::TorsionConstraintContrib
A dihedral angle range constraint modelled after a TorsionContrib.
Definition TorsionConstraint.h:21
export.h
ForceFields::UFF
Definition UFF/AtomTyper.h:19
ForceFields::UFF::TorsionConstraintContrib
ForceFields::TorsionConstraintContrib TorsionConstraintContrib
Definition UFF/TorsionConstraint.h:17
ForceFields
Definition TorsionAngleContribs.h:21