compound.cc

//------------------------------------------------------------------------------
// This file is part of the OpenStructure project <www.openstructure.org>
//
// Copyright (C) 2008-2011 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
//------------------------------------------------------------------------------
#include "compound.hh"

namespace ost { namespace conop {


int Compound::GetAtomSpecIndex(const String& name) const {
  AtomSpecList::const_iterator i=atom_specs_.begin();
  for (; i!=atom_specs_.end(); ++i) {
    if ((*i).name==name || (*i).alt_name==name)
      return std::distance(atom_specs_.begin(), i);
  }
  return -1;
}
}}