/*! * Copyright 2014-2019 by Contributors * \file gbtree.cc * \brief gradient boosted tree implementation. * \author Tianqi Chen */ #include #include #include #include #include #include #include #include #include #include #include #include #include #include "../common/common.h" #include "../common/host_device_vector.h" #include "../common/random.h" #include "gbtree.h" #include "gbtree_model.h" #include "../common/timer.h" namespace xgboost { namespace gbm { DMLC_REGISTRY_FILE_TAG(gbtree); void GBTree::Configure(const Args& cfg) { this->cfg_ = cfg; tparam_.InitAllowUnknown(cfg); model_.Configure(cfg); // for the 'update' process_type, move trees into trees_to_update if (tparam_.process_type == TreeProcessType::kUpdate) { model_.InitTreesToUpdate(); } // configure predictors if (!cpu_predictor_) { cpu_predictor_ = std::unique_ptr( Predictor::Create("cpu_predictor", this->learner_param_)); cpu_predictor_->Configure(cfg, cache_); } #if defined(XGBOOST_USE_CUDA) if (!gpu_predictor_) { gpu_predictor_ = std::unique_ptr( Predictor::Create("gpu_predictor", this->learner_param_)); gpu_predictor_->Configure(cfg, cache_); } #endif // defined(XGBOOST_USE_CUDA) monitor_.Init("GBTree"); specified_predictor_ = std::any_of(cfg.cbegin(), cfg.cend(), [](std::pair const& arg) { return arg.first == "predictor"; }); if (!specified_predictor_ && tparam_.tree_method == TreeMethod::kGPUHist) { tparam_.predictor = "gpu_predictor"; } specified_updater_ = std::any_of(cfg.cbegin(), cfg.cend(), [](std::pair const& arg) { return arg.first == "updater"; }); if (specified_updater_) { LOG(WARNING) << "DANGER AHEAD: You have manually specified `updater` " "parameter. The `tree_method` parameter will be ignored. " "Incorrect sequence of updaters will produce undefined " "behavior. For common uses, we recommend using " "`tree_method` parameter instead."; } else { this->ConfigureUpdaters(); LOG(DEBUG) << "Using updaters: " << tparam_.updater_seq; } configured_ = true; } // FIXME(trivialfis): This handles updaters and predictor. Because the choice of updaters // depends on whether external memory is used and how large is dataset. We can remove the // dependency on DMatrix once `hist` tree method can handle external memory so that we can // make it default. void GBTree::ConfigureWithKnownData(Args const& cfg, DMatrix* fmat) { std::string updater_seq = tparam_.updater_seq; this->PerformTreeMethodHeuristic(fmat); this->ConfigureUpdaters(); // initialize the updaters only when needed. if (updater_seq != tparam_.updater_seq) { LOG(DEBUG) << "Using updaters: " << tparam_.updater_seq; this->updaters_.clear(); } this->InitUpdater(cfg); } void GBTree::PerformTreeMethodHeuristic(DMatrix* fmat) { if (specified_updater_) { // This method is disabled when `updater` parameter is explicitly // set, since only experts are expected to do so. return; } // tparam_ is set before calling this function. if (tparam_.tree_method != TreeMethod::kAuto) { return; } tparam_.updater_seq = "grow_histmaker,prune"; if (rabit::IsDistributed()) { LOG(WARNING) << "Tree method is automatically selected to be 'approx' " "for distributed training."; tparam_.tree_method = TreeMethod::kApprox; } else if (!fmat->SingleColBlock()) { LOG(WARNING) << "Tree method is automatically set to 'approx' " "since external-memory data matrix is used."; tparam_.tree_method = TreeMethod::kApprox; } else if (fmat->Info().num_row_ >= (4UL << 20UL)) { /* Choose tree_method='approx' automatically for large data matrix */ LOG(WARNING) << "Tree method is automatically selected to be " "'approx' for faster speed. To use old behavior " "(exact greedy algorithm on single machine), " "set tree_method to 'exact'."; tparam_.tree_method = TreeMethod::kApprox; } else { tparam_.tree_method = TreeMethod::kExact; } LOG(DEBUG) << "Using tree method: " << static_cast(tparam_.tree_method); } void GBTree::ConfigureUpdaters() { // `updater` parameter was manually specified /* Choose updaters according to tree_method parameters */ switch (tparam_.tree_method) { case TreeMethod::kAuto: // Use heuristic to choose between 'exact' and 'approx' This // choice is carried out in PerformTreeMethodHeuristic() before // calling this function. break; case TreeMethod::kApprox: tparam_.updater_seq = "grow_histmaker,prune"; break; case TreeMethod::kExact: tparam_.updater_seq = "grow_colmaker,prune"; break; case TreeMethod::kHist: LOG(INFO) << "Tree method is selected to be 'hist', which uses a " "single updater grow_quantile_histmaker."; tparam_.updater_seq = "grow_quantile_histmaker"; break; case TreeMethod::kGPUHist: this->AssertGPUSupport(); tparam_.updater_seq = "grow_gpu_hist"; if (!specified_predictor_) { tparam_.predictor = "gpu_predictor"; } break; default: LOG(FATAL) << "Unknown tree_method (" << static_cast(tparam_.tree_method) << ") detected"; } } void GBTree::DoBoost(DMatrix* p_fmat, HostDeviceVector* in_gpair, ObjFunction* obj) { std::vector > > new_trees; const int ngroup = model_.param.num_output_group; ConfigureWithKnownData(this->cfg_, p_fmat); monitor_.Start("BoostNewTrees"); if (ngroup == 1) { std::vector > ret; BoostNewTrees(in_gpair, p_fmat, 0, &ret); new_trees.push_back(std::move(ret)); } else { CHECK_EQ(in_gpair->Size() % ngroup, 0U) << "must have exactly ngroup*nrow gpairs"; // TODO(canonizer): perform this on GPU if HostDeviceVector has device set. HostDeviceVector tmp(in_gpair->Size() / ngroup, GradientPair(), in_gpair->DeviceIdx()); const auto& gpair_h = in_gpair->ConstHostVector(); auto nsize = static_cast(tmp.Size()); for (int gid = 0; gid < ngroup; ++gid) { std::vector& tmp_h = tmp.HostVector(); #pragma omp parallel for schedule(static) for (bst_omp_uint i = 0; i < nsize; ++i) { tmp_h[i] = gpair_h[i * ngroup + gid]; } std::vector > ret; BoostNewTrees(&tmp, p_fmat, gid, &ret); new_trees.push_back(std::move(ret)); } } monitor_.Stop("BoostNewTrees"); this->CommitModel(std::move(new_trees)); } void GBTree::InitUpdater(Args const& cfg) { std::string tval = tparam_.updater_seq; std::vector ups = common::Split(tval, ','); if (updaters_.size() != 0) { // Assert we have a valid set of updaters. CHECK_EQ(ups.size(), updaters_.size()); for (auto const& up : updaters_) { bool contains = std::any_of(ups.cbegin(), ups.cend(), [&up](std::string const& name) { return name == up->Name(); }); if (!contains) { std::stringstream ss; ss << "Internal Error: " << " mismatched updater sequence.\n"; ss << "Specified updaters: "; std::for_each(ups.cbegin(), ups.cend(), [&ss](std::string const& name){ ss << name << " "; }); ss << "\n" << "Actual updaters: "; std::for_each(updaters_.cbegin(), updaters_.cend(), [&ss](std::unique_ptr const& updater){ ss << updater->Name() << " "; }); LOG(FATAL) << ss.str(); } } return; } for (const std::string& pstr : ups) { std::unique_ptr up(TreeUpdater::Create(pstr.c_str(), learner_param_)); up->Configure(cfg); updaters_.push_back(std::move(up)); } } void GBTree::BoostNewTrees(HostDeviceVector* gpair, DMatrix *p_fmat, int bst_group, std::vector >* ret) { std::vector new_trees; ret->clear(); // create the trees for (int i = 0; i < tparam_.num_parallel_tree; ++i) { if (tparam_.process_type == TreeProcessType::kDefault) { // create new tree std::unique_ptr ptr(new RegTree()); ptr->param.InitAllowUnknown(this->cfg_); new_trees.push_back(ptr.get()); ret->push_back(std::move(ptr)); } else if (tparam_.process_type == TreeProcessType::kUpdate) { CHECK_LT(model_.trees.size(), model_.trees_to_update.size()); // move an existing tree from trees_to_update auto t = std::move(model_.trees_to_update[model_.trees.size() + bst_group * tparam_.num_parallel_tree + i]); new_trees.push_back(t.get()); ret->push_back(std::move(t)); } } // update the trees for (auto& up : updaters_) { up->Update(gpair, p_fmat, new_trees); } } void GBTree::CommitModel(std::vector>>&& new_trees) { monitor_.Start("CommitModel"); int num_new_trees = 0; for (int gid = 0; gid < model_.param.num_output_group; ++gid) { num_new_trees += new_trees[gid].size(); model_.CommitModel(std::move(new_trees[gid]), gid); } CHECK(configured_); GetPredictor()->UpdatePredictionCache(model_, &updaters_, num_new_trees); monitor_.Stop("CommitModel"); } // dart class Dart : public GBTree { public: explicit Dart(bst_float base_margin) : GBTree(base_margin) {} void Configure(const Args& cfg) override { GBTree::Configure(cfg); if (model_.trees.size() == 0) { dparam_.InitAllowUnknown(cfg); } } void Load(dmlc::Stream* fi) override { GBTree::Load(fi); weight_drop_.resize(model_.param.num_trees); if (model_.param.num_trees != 0) { fi->Read(&weight_drop_); } } void Save(dmlc::Stream* fo) const override { GBTree::Save(fo); if (weight_drop_.size() != 0) { fo->Write(weight_drop_); } } // predict the leaf scores with dropout if ntree_limit = 0 void PredictBatch(DMatrix* p_fmat, HostDeviceVector* out_preds, unsigned ntree_limit) override { DropTrees(ntree_limit); PredLoopInternal(p_fmat, &out_preds->HostVector(), 0, ntree_limit, true); } void PredictInstance(const SparsePage::Inst& inst, std::vector* out_preds, unsigned ntree_limit, unsigned root_index) override { DropTrees(1); if (thread_temp_.size() == 0) { thread_temp_.resize(1, RegTree::FVec()); thread_temp_[0].Init(model_.param.num_feature); } out_preds->resize(model_.param.num_output_group); ntree_limit *= model_.param.num_output_group; if (ntree_limit == 0 || ntree_limit > model_.trees.size()) { ntree_limit = static_cast(model_.trees.size()); } // loop over output groups for (int gid = 0; gid < model_.param.num_output_group; ++gid) { (*out_preds)[gid] = PredValue(inst, gid, root_index, &thread_temp_[0], 0, ntree_limit) + model_.base_margin; } } bool UseGPU() const override { return false; } protected: friend class GBTree; // internal prediction loop // add predictions to out_preds template inline void PredLoopInternal( DMatrix* p_fmat, std::vector* out_preds, unsigned tree_begin, unsigned ntree_limit, bool init_out_preds) { int num_group = model_.param.num_output_group; ntree_limit *= num_group; if (ntree_limit == 0 || ntree_limit > model_.trees.size()) { ntree_limit = static_cast(model_.trees.size()); } if (init_out_preds) { size_t n = num_group * p_fmat->Info().num_row_; const auto& base_margin = p_fmat->Info().base_margin_.ConstHostVector(); out_preds->resize(n); if (base_margin.size() != 0) { CHECK_EQ(out_preds->size(), n); std::copy(base_margin.begin(), base_margin.end(), out_preds->begin()); } else { std::fill(out_preds->begin(), out_preds->end(), model_.base_margin); } } if (num_group == 1) { PredLoopSpecalize(p_fmat, out_preds, 1, tree_begin, ntree_limit); } else { PredLoopSpecalize(p_fmat, out_preds, num_group, tree_begin, ntree_limit); } } template inline void PredLoopSpecalize( DMatrix* p_fmat, std::vector* out_preds, int num_group, unsigned tree_begin, unsigned tree_end) { const MetaInfo& info = p_fmat->Info(); const int nthread = omp_get_max_threads(); CHECK_EQ(num_group, model_.param.num_output_group); InitThreadTemp(nthread); std::vector& preds = *out_preds; CHECK_EQ(model_.param.size_leaf_vector, 0) << "size_leaf_vector is enforced to 0 so far"; CHECK_EQ(preds.size(), p_fmat->Info().num_row_ * num_group); // start collecting the prediction auto* self = static_cast(this); for (const auto &batch : p_fmat->GetBatches()) { constexpr int kUnroll = 8; const auto nsize = static_cast(batch.Size()); const bst_omp_uint rest = nsize % kUnroll; #pragma omp parallel for schedule(static) for (bst_omp_uint i = 0; i < nsize - rest; i += kUnroll) { const int tid = omp_get_thread_num(); RegTree::FVec& feats = thread_temp_[tid]; int64_t ridx[kUnroll]; SparsePage::Inst inst[kUnroll]; for (int k = 0; k < kUnroll; ++k) { ridx[k] = static_cast(batch.base_rowid + i + k); } for (int k = 0; k < kUnroll; ++k) { inst[k] = batch[i + k]; } for (int k = 0; k < kUnroll; ++k) { for (int gid = 0; gid < num_group; ++gid) { const size_t offset = ridx[k] * num_group + gid; preds[offset] += self->PredValue(inst[k], gid, info.GetRoot(ridx[k]), &feats, tree_begin, tree_end); } } } for (bst_omp_uint i = nsize - rest; i < nsize; ++i) { RegTree::FVec& feats = thread_temp_[0]; const auto ridx = static_cast(batch.base_rowid + i); const SparsePage::Inst inst = batch[i]; for (int gid = 0; gid < num_group; ++gid) { const size_t offset = ridx * num_group + gid; preds[offset] += self->PredValue(inst, gid, info.GetRoot(ridx), &feats, tree_begin, tree_end); } } } } // commit new trees all at once void CommitModel(std::vector>>&& new_trees) override { int num_new_trees = 0; for (int gid = 0; gid < model_.param.num_output_group; ++gid) { num_new_trees += new_trees[gid].size(); model_.CommitModel(std::move(new_trees[gid]), gid); } size_t num_drop = NormalizeTrees(num_new_trees); LOG(INFO) << "drop " << num_drop << " trees, " << "weight = " << weight_drop_.back(); } // predict the leaf scores without dropped trees inline bst_float PredValue(const SparsePage::Inst &inst, int bst_group, unsigned root_index, RegTree::FVec *p_feats, unsigned tree_begin, unsigned tree_end) { bst_float psum = 0.0f; p_feats->Fill(inst); for (size_t i = tree_begin; i < tree_end; ++i) { if (model_.tree_info[i] == bst_group) { bool drop = (std::binary_search(idx_drop_.begin(), idx_drop_.end(), i)); if (!drop) { int tid = model_.trees[i]->GetLeafIndex(*p_feats, root_index); psum += weight_drop_[i] * (*model_.trees[i])[tid].LeafValue(); } } } p_feats->Drop(inst); return psum; } // select which trees to drop inline void DropTrees(unsigned ntree_limit_drop) { idx_drop_.clear(); if (ntree_limit_drop > 0) return; std::uniform_real_distribution<> runif(0.0, 1.0); auto& rnd = common::GlobalRandom(); bool skip = false; if (dparam_.skip_drop > 0.0) skip = (runif(rnd) < dparam_.skip_drop); // sample some trees to drop if (!skip) { if (dparam_.sample_type == 1) { bst_float sum_weight = 0.0; for (auto elem : weight_drop_) { sum_weight += elem; } for (size_t i = 0; i < weight_drop_.size(); ++i) { if (runif(rnd) < dparam_.rate_drop * weight_drop_.size() * weight_drop_[i] / sum_weight) { idx_drop_.push_back(i); } } if (dparam_.one_drop && idx_drop_.empty() && !weight_drop_.empty()) { // the expression below is an ugly but MSVC2013-friendly equivalent of // size_t i = std::discrete_distribution(weight_drop.begin(), // weight_drop.end())(rnd); size_t i = std::discrete_distribution( weight_drop_.size(), 0., static_cast(weight_drop_.size()), [this](double x) -> double { return weight_drop_[static_cast(x)]; })(rnd); idx_drop_.push_back(i); } } else { for (size_t i = 0; i < weight_drop_.size(); ++i) { if (runif(rnd) < dparam_.rate_drop) { idx_drop_.push_back(i); } } if (dparam_.one_drop && idx_drop_.empty() && !weight_drop_.empty()) { size_t i = std::uniform_int_distribution(0, weight_drop_.size() - 1)(rnd); idx_drop_.push_back(i); } } } } // set normalization factors inline size_t NormalizeTrees(size_t size_new_trees) { float lr = 1.0 * dparam_.learning_rate / size_new_trees; size_t num_drop = idx_drop_.size(); if (num_drop == 0) { for (size_t i = 0; i < size_new_trees; ++i) { weight_drop_.push_back(1.0); } } else { if (dparam_.normalize_type == 1) { // normalize_type 1 float factor = 1.0 / (1.0 + lr); for (auto i : idx_drop_) { weight_drop_[i] *= factor; } for (size_t i = 0; i < size_new_trees; ++i) { weight_drop_.push_back(factor); } } else { // normalize_type 0 float factor = 1.0 * num_drop / (num_drop + lr); for (auto i : idx_drop_) { weight_drop_[i] *= factor; } for (size_t i = 0; i < size_new_trees; ++i) { weight_drop_.push_back(1.0 / (num_drop + lr)); } } } // reset idx_drop_.clear(); return num_drop; } // init thread buffers inline void InitThreadTemp(int nthread) { int prev_thread_temp_size = thread_temp_.size(); if (prev_thread_temp_size < nthread) { thread_temp_.resize(nthread, RegTree::FVec()); for (int i = prev_thread_temp_size; i < nthread; ++i) { thread_temp_[i].Init(model_.param.num_feature); } } } // --- data structure --- // training parameter DartTrainParam dparam_; /*! \brief prediction buffer */ std::vector weight_drop_; // indexes of dropped trees std::vector idx_drop_; // temporal storage for per thread std::vector thread_temp_; }; // register the objective functions DMLC_REGISTER_PARAMETER(GBTreeModelParam); DMLC_REGISTER_PARAMETER(GBTreeTrainParam); DMLC_REGISTER_PARAMETER(DartTrainParam); XGBOOST_REGISTER_GBM(GBTree, "gbtree") .describe("Tree booster, gradient boosted trees.") .set_body([](const std::vector >& cached_mats, bst_float base_margin) { auto* p = new GBTree(base_margin); p->InitCache(cached_mats); return p; }); XGBOOST_REGISTER_GBM(Dart, "dart") .describe("Tree booster, dart.") .set_body([](const std::vector >& cached_mats, bst_float base_margin) { GBTree* p = new Dart(base_margin); return p; }); } // namespace gbm } // namespace xgboost