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Collection of hyperparameter optimization benchmark problems

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HPOBench

HPOBench is a library for hyperparameter optimization and black-box optimization benchmark with a focus on reproducibility.

Note: HPOBench is under active construction. Stay tuned for more benchmarks. Information on how to contribute a new benchmark will follow shortly.

Note: If you are looking for a different or older version of our benchmarking library, you might be looking for HPOlib1.5

In 4 lines of code

Run a random configuration within a singularity container

from hpobench.container.benchmarks.ml.xgboost_benchmark import XGBoostBenchmark
b = XGBoostBenchmark(task_id=167149, container_source='library://phmueller/automl', rng=1)
config = b.get_configuration_space(seed=1).sample_configuration()
result_dict = b.objective_function(configuration=config, fidelity={"n_estimators": 128, "subsample": 0.5}, rng=1)

All benchmarks can also be queried with fewer or no fidelities:

from hpobench.container.benchmarks.ml.xgboost_benchmark import XGBoostBenchmark
b = XGBoostBenchmark(task_id=167149, container_source='library://phmueller/automl', rng=1)
config = b.get_configuration_space(seed=1).sample_configuration()
result_dict = b.objective_function(configuration=config, fidelity={"n_estimators": 128,}, rng=1)
result_dict = b.objective_function(configuration=config, rng=1)

Containerized benchmarks do not rely on external dependencies and thus do not change. To do so, we rely on Singularity (version 3.5).

Further requirements are: ConfigSpace, scipy and numpy

Note: Each benchmark can also be run locally, but the dependencies must be installed manually and might conflict with other benchmarks. This can be arbitrarily complex and further information can be found in the docstring of the benchmark.

A simple example is the XGBoost benchmark which can be installed with pip install .[xgboost]

from hpobench.benchmarks.ml.xgboost_benchmark import XGBoostBenchmark
b = XGBoostBenchmark(task_id=167149)
config = b.get_configuration_space(seed=1).sample_configuration()
result_dict = b.objective_function(configuration=config, fidelity={"n_estimators": 128, "subsample": 0.5}, rng=1)

Installation

Before we start, we recommend using a virtual environment. To run any benchmark using its singularity container, run the following:

git clone https://github.com/automl/HPOBench.git
cd HPOBench 
pip install .

Note: This does not install singularity (version 3.5). Please follow the steps described here: user-guide.

Available Containerized Benchmarks

Benchmark Name Container Name Container Source Hosted at Additional Info
XGBoostBenchmark xgboost_benchmark library://phmueller/automl/xgboost_benchmark Sylabs Works with OpenML task ids
SupportVectorMachine svm_benchmark library://phmueller/automl/svm_benchmark Sylabs Works with OpenML task ids
BNNOnToyFunction pybnn library://phmueller/automl/pybnn Sylabs
BNNOnBostonHousing pybnn library://phmueller/automl/pybnn Sylabs
BNNOnProteinStructure pybnn library://phmueller/automl/pybnn Sylabs
BNNOnYearPrediction pybnn library://phmueller/automl/pybnn Sylabs
CartpoleFull cartpole library://phmueller/automl/cartpole Sylabs Not deterministic
CartpoleReduced cartpole library://phmueller/automl/cartpole Sylabs Not deterministic
Learna learna_benchmark library://phmueller/automl/learna_benchmark Sylabs Not deterministic
MetaLearna learna_benchmark library://phmueller/automl/learna_benchmark Sylabs Not deterministic
SliceLocalizationBenchmark tabular_benchmarks library://phmueller/automl/tabular_benchmarks Sylabs Loading may take several minutes
ProteinStructureBenchmark tabular_benchmarks library://phmueller/automl/tabular_benchmarks Sylabs Loading may take several minutes
NavalPropulsionBenchmark tabular_benchmarks library://phmueller/automl/tabular_benchmarks Sylabs Loading may take several minutes
ParkinsonsTelemonitoringBenchmark tabular_benchmarks library://phmueller/automl/tabular_benchmarks Sylabs Loading may take several minutes
NASCifar10ABenchmark nasbench_101 library://phmueller/automl/nasbench_101 Sylabs Loading may take several minutes
NASCifar10BBenchmark nasbench_101 library://phmueller/automl/nasbench_101 Sylabs Loading may take several minutes
NASCifar10CBenchmark nasbench_101 library://phmueller/automl/nasbench_101 Sylabs Loading may take several minutes
Cifar10NasBench201Benchmark nasbench_201 library://phmueller/automl/nasbench_201 Sylabs Loading may take several minutes
Cifar100NasBench201Benchmark nasbench_201 library://phmueller/automl/nasbench_201 Sylabs Loading may take several minutes
Cifar10ValidNasBench201Benchmark nasbench_201 library://phmueller/automl/nasbench_201 Sylabs Loading may take several minutes
ImageNetNasBench201Benchmark nasbench_201 library://phmueller/automl/nasbench_201 Sylabs Loading may take several minutes
NASBench1shot1SearchSpace1Benchmark nasbench_1shot1 library://phmueller/automl/nasbench_1shot1 Sylabs Loading may take several minutes
NASBench1shot1SearchSpace2Benchmark nasbench_1shot1 library://phmueller/automl/nasbench_1shot1 Sylabs Loading may take several minutes
NASBench1shot1SearchSpace3Benchmark nasbench_1shot1 library://phmueller/automl/nasbench_1shot1 Sylabs Loading may take several minutes
ParamNetAdultOnStepsBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetAdultOnTimeBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetHiggsOnStepsBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetHiggsOnTimeBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetLetterOnStepsBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetLetterOnTimeBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetMnistOnStepsBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetMnistOnTimeBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetOptdigitsOnStepsBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetOptdigitsOnTimeBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetPokerOnStepsBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetPokerOnTimeBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetVehicleOnStepsBenchmark paramnet library://phmueller/automl/paramnet Sylabs
ParamNetVehicleOnTimeBenchmark paramnet library://phmueller/automl/paramnet Sylabs

Further Notes

How to build a container locally

With singularity installed run the following to built the xgboost container

cd hpobench/container/recipes/ml
sudo singularity build xgboost_benchmark Singularity.XGBoostBenchmark

You can use this local image with:

from hpobench.container.benchmarks.ml.xgboost_benchmark import XGBoostBenchmark
b = XGBoostBenchmark(task_id=167149, container_name="xgboost_benchmark", 
                     container_source='./') # path to hpobench/container/recipes/ml
config = b.get_configuration_space(seed=1).sample_configuration()
result_dict = b.objective_function(config, fidelity={"n_estimators": 128, "subsample": 0.5})

Remove all caches

HPOBench data

HPOBench stores downloaded containers and datasets at the following locations:

$XDG_CONFIG_HOME # ~/.config/hpobench
$XDG_CACHE_HOME # ~/.cache/hpobench
$XDG_DATA_HOME # ~/.local/share/hpobench

For crashes or when not properly shutting down containers, there might be socket files left under /tmp/.

OpenML data

OpenML data additionally maintains it's own cache which is located at ~/.openml/

Singularity container

Singularity additionally maintains it's own cache which can be removed with singularity cache clean

Troubleshooting

  • Singularity throws an 'Invalid Image format' exception Use a singularity version > 3. For users of the Meta-Cluster in Freiburg, you have to set the following path: export PATH=/usr/local/kislurm/singularity-3.5/bin/:$PATH

  • A Benchmark fails with SystemError: Could not start a instance of the benchmark. Retried 5 times but the container can be started locally with singularity instance start <pathtocontainer> test See whether in ~/.singularity/instances/sing/$HOSTNAME/*/ there is a file that does not end with '}'. If yes delete this file and retry.

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Collection of hyperparameter optimization benchmark problems

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