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//------------------------------------------------------------------------------
// This file is part of the OpenStructure project <www.openstructure.org>
//
// Copyright (C) 2008-2020 by the OpenStructure authors
//
// This library is free software; you can redistribute it and/or modify it under
// the terms of the GNU Lesser General Public License as published by the Free
// Software Foundation; either version 3.0 of the License, or (at your option)
// any later version.
// This library is distributed in the hope that it will be useful, but WITHOUT
// ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS
// FOR A PARTICULAR PURPOSE. See the GNU Lesser General Public License for more
// details.
//
// You should have received a copy of the GNU Lesser General Public License
// along with this library; if not, write to the Free Software Foundation, Inc.,
// 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA
//------------------------------------------------------------------------------
/*
* Authors: Marco Biasini, Juergen Haas
*/
#define BOOST_TEST_DYN_LINK
#include <boost/test/unit_test.hpp>
#include <ost/mol/mol.hh>
#include <ost/log.hh>
#include <ost/message.hh>
#include <ost/geom/geom.hh>
using namespace ost;
using namespace ost::mol;
class E : public EntityVisitor {
public:
virtual bool VisitTorsion(const TorsionHandle& t) {
throw Error("should never get here");
return false;
}
};
struct Fixture {
Fixture() {
e=CreateEntity();
XCSEditor editor=e.EditXCS();
c=editor.InsertChain("A");
r=editor.AppendResidue(c, "XXX");
aa=editor.InsertAtom(r, "A", geom::Vec3());
ab=editor.InsertAtom(r, "B", geom::Vec3());
ac=editor.InsertAtom(r, "C", geom::Vec3());
ad=editor.InsertAtom(r, "D", geom::Vec3());
BondHandle b1=editor.Connect(aa, ab);
BondHandle b2=editor.Connect(ab, ac);
BondHandle b3=editor.Connect(ac, ad);
t=editor.AddTorsion("TORSION", aa, ab, ac, ad);
}
EntityHandle e;
ChainHandle c;
ResidueHandle r;
AtomHandle aa;
AtomHandle ab;
AtomHandle ac;
AtomHandle ad;
TorsionHandle t;
};
BOOST_AUTO_TEST_SUITE( mol_base );
BOOST_AUTO_TEST_CASE(atom_delete)
{
Fixture f;
XCSEditor e=f.e.EditXCS();
e.DeleteAtom(f.ab);
E ev;
BOOST_CHECK_NO_THROW(f.e.Apply(ev));
}
BOOST_AUTO_TEST_SUITE_END();
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