/** * \file PairConstraint.cpp * \brief Use a PairModifier applied to a PairContainer to * maintain an invariant * * This file is generated by a script (core/tools/make-container). * Do not edit directly. * * Copyright 2007-2010 IMP Inventors. All rights reserved. * */ #include "IMP/core/PairConstraint.h" #include "IMP/internal/container_helpers.h" IMPCORE_BEGIN_NAMESPACE PairConstraint::PairConstraint(PairModifier *before, PairModifier *after, const ParticlePair& vt, std::string name): Constraint(name), v_(vt){ if (before) f_=before; if (after) af_=after; } void PairConstraint::do_update_attributes() { IMP_OBJECT_LOG; if (!f_) return; IMP_LOG(TERSE, "Begin PairsConstraint::update" << std::endl); IMP_CHECK_OBJECT(f_); f_->apply(v_); IMP_LOG(TERSE, "End PairsConstraint::update" << std::endl); } void PairConstraint::do_update_derivatives(DerivativeAccumulator *da) { IMP_OBJECT_LOG; if (!af_) return; IMP_LOG(TERSE, "Begin PairsConstraint::after_evaluate" << std::endl); IMP_CHECK_OBJECT(af_); af_->apply(v_, *da); IMP_LOG(TERSE, "End PairsConstraint::after_evaluate" << std::endl); } ContainersTemp PairConstraint::get_input_containers() const { return ContainersTemp(); } ContainersTemp PairConstraint::get_output_containers() const { return ContainersTemp(); } ParticlesTemp PairConstraint::get_input_particles() const { ParticlesTemp ret; if (f_) { ret= IMP::internal::get_input_particles(f_.get(), v_); ParticlesTemp o= IMP::internal::get_output_particles(f_.get(), v_); ret.insert(ret.end(), o.begin(), o.end()); IMP_IF_CHECK(USAGE) { if (af_) { ParticlesTemp oret= IMP::internal::get_input_particles(af_.get(), v_); std::sort(ret.begin(), ret.end()); std::sort(oret.begin(), oret.end()); ParticlesTemp t; std::set_union(ret.begin(), ret.end(), oret.begin(), oret.end(), std::back_inserter(t)); IMP_USAGE_CHECK(t.size() == ret.size(), "The particles written by " << " the after modifier in " << get_name() << " must " << "be a subset of those read by the before " << "modifier. Before: " << Particles(ret) << " and after " << Particles(oret)); } } } else { ret=IMP::internal::get_output_particles(af_.get(), v_); } return ret; } ParticlesTemp PairConstraint::get_output_particles() const { ParticlesTemp ret; if (f_) { ret= IMP::internal::get_output_particles(f_.get(), v_); IMP_IF_CHECK(USAGE) { if (af_) { ParticlesTemp oret= IMP::internal::get_input_particles(af_.get(), v_); ParticlesTemp iret=IMP::internal::get_input_particles(f_.get(), v_); iret.insert(iret.end(), ret.begin(), ret.end()); std::sort(iret.begin(), iret.end()); std::sort(oret.begin(), oret.end()); ParticlesTemp t; std::set_union(iret.begin(), iret.end(), oret.begin(), oret.end(), std::back_inserter(t)); IMP_USAGE_CHECK(t.size() == iret.size(), "The particles read by " << " the after modifier in " << get_name() << " must " << "be a subset of those written by the before" << " modifier."); } } } else { ret= IMP::internal::get_input_particles(af_.get(), v_); } return ret; } void PairConstraint::do_show(std::ostream &out) const { out << "on " << IMP::internal::streamable(v_) << std::endl; if (f_) out << "before " << *f_ << std::endl; if (af_) out << "after " << *af_ << std::endl; } IMPCORE_END_NAMESPACE