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coulomb.h
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// -*- Mode: C++; tab-width: 2; -*-
// vi: set ts=2:
//
// $Id: coulomb.h,v 1.13 2005/12/23 17:01:43 amoll Exp $
//
#ifndef BALL_ENERGY_COULOMB_H
#define BALL_ENERGY_COULOMB_H
#ifndef BALL_COMMON_H
# include <BALL/common.h>
#endif
namespace BALL
{
class AtomContainer;
BALL_EXPORT double calculateCoulomb(const AtomContainer& atoms);
} // namespace BALL
#endif // BALL_ENERGY_COULOMB_H
BALL_EXPORT
#define BALL_EXPORT
Definition COMMON/global.h:50
BALL::AtomContainer
Definition atomContainer.h:32
common.h
BALL::calculateCoulomb
BALL_EXPORT double calculateCoulomb(const AtomContainer &atoms)
BALL::atoms
BALL_EXPORT AtomList atoms(const AtomContainer &fragment, const String &expression=String())
BALL
Definition constants.h:13