RestrictOperationsBase.cc

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// -*- mode:c++;tab-width:2;indent-tabs-mode:t;show-trailing-whitespace:t;rm-trailing-spaces:t -*-
// vi: set ts=2 noet:
//
// (c) Copyright Rosetta Commons Member Institutions.
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// (c) The Rosetta software is developed by the contributing members of the Rosetta Commons.
// (c) For more information, see http://www.rosettacommons.org. Questions about this can be
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/// @file   protocols/toolbox/task_operations/RestrictOperationsBase.cc
/// @brief  Base class for PoseMetricCalculator-using TaskOperations
/// @author Steven Lewis smlewi@gmail.com

// Unit Headers
#include <protocols/toolbox/task_operations/RestrictOperationsBase.hh>

// Project Headers
#include <core/pose/Pose.hh>

#include <basic/MetricValue.hh>

// Utility Headers
//#include <core/types.hh>
#include <utility/vector1_bool.hh>
//#include <basic/Tracer.hh>

// C++ headers
#include <set>

#include <utility/vector1.hh>

//static basic::Tracer TR( "protocols.toolbox.TaskOperations.RestrictOperationsBase" );

namespace protocols {
namespace toolbox {
namespace task_operations {

RestrictOperationsBase::RestrictOperationsBase() : parent() {}

RestrictOperationsBase::~RestrictOperationsBase() {}

void
RestrictOperationsBase::run_calculator(
  core::pose::Pose const & pose,
  std::string const & calculator,
  std::string const & calculation,
  utility::vector1_bool & residues ) const
{
  runtime_assert(residues.size() == pose.total_residue());

  //find the set of residues
  typedef std::set< core::Size > SizeSet;
  basic::MetricValue< SizeSet > mv_sizeset;
  pose.metric(calculator, calculation, mv_sizeset);
  SizeSet const & sizeset(mv_sizeset.value());

  //insert this into the vector
  for(SizeSet::const_iterator it(sizeset.begin()), end(sizeset.end()) ; it != end; ++it){
    //TR << *it << std::endl;
    residues[*it] = true;
  }

  return;
}

} //namespace protocols
} //namespace toolbox
} //namespace task_operations