494 lines
19 KiB
Python
494 lines
19 KiB
Python
import json
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import logging
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import pickle
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from collections import defaultdict
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from typing import TYPE_CHECKING, Any, Dict, List, Optional, Tuple
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from ray.tune.result import DEFAULT_METRIC
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from ray.tune.search import (
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UNDEFINED_METRIC_MODE,
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UNDEFINED_SEARCH_SPACE,
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UNRESOLVED_SEARCH_SPACE,
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Searcher,
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)
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from ray.tune.search.sample import Domain, Float, Quantized, Uniform
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from ray.tune.search.variant_generator import parse_spec_vars
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from ray.tune.utils import flatten_dict
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from ray.tune.utils.util import is_nan_or_inf, unflatten_dict
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try: # Python 3 only -- needed for lint test.
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import bayes_opt as byo
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except ImportError:
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byo = None
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if TYPE_CHECKING:
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from ray.tune import ExperimentAnalysis
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logger = logging.getLogger(__name__)
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def _dict_hash(config, precision):
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flatconfig = flatten_dict(config)
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for param, value in flatconfig.items():
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if isinstance(value, float):
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flatconfig[param] = "{:.{digits}f}".format(value, digits=precision)
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hashed = json.dumps(flatconfig, sort_keys=True, default=str)
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return hashed
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class BayesOptSearch(Searcher):
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"""Uses bayesian-optimization/BayesianOptimization to optimize hyperparameters.
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bayesian-optimization/BayesianOptimization is a library for Bayesian Optimization. More
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info can be found here: https://github.com/bayesian-optimization/BayesianOptimization.
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This searcher will automatically filter out any NaN, inf or -inf
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results.
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You will need to install bayesian-optimization/BayesianOptimization via the following:
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.. code-block:: bash
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pip install bayesian-optimization==1.4.3
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Initializing this search algorithm with a ``space`` requires that it's
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in the ``BayesianOptimization`` search space format. Otherwise, you
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should instead pass in a Tune search space into ``Tuner(param_space=...)``,
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and the search space will be automatically converted for you.
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See this ``BayesianOptimization`` example notebook
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<https://github.com/bayesian-optimization/BayesianOptimization/blob/33b99ec0a4fc51239e1a2fca3eaa37ad6debac5d/examples/advanced-tour.ipynb>`_
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for an example.
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Args:
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space: Continuous search space. Parameters will be sampled from
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this space which will be used to run trials.
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metric: The training result objective value attribute. If None
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but a mode was passed, the anonymous metric `_metric` will be used
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per default.
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mode: One of {min, max}. Determines whether objective is
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minimizing or maximizing the metric attribute.
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points_to_evaluate: Initial parameter suggestions to be run
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first. This is for when you already have some good parameters
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you want to run first to help the algorithm make better suggestions
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for future parameters. Needs to be a list of dicts containing the
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configurations.
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utility_kwargs: Parameters to define the utility function.
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The default value is a dictionary with three keys:
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- kind: ucb (Upper Confidence Bound)
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- kappa: 2.576
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- xi: 0.0
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random_state: Used to initialize BayesOpt.
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random_search_steps: Number of initial random searches.
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This is necessary to avoid initial local overfitting
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of the Bayesian process.
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verbose: Sets verbosity level for BayesOpt packages.
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patience: Number of times a configuration may be repeatedly suggested
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before the search terminates early. The Bayesian optimizer can
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converge and keep proposing the same point; when a configuration is
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suggested more than ``patience`` times, ``suggest`` returns
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``Searcher.FINISHED`` and no further trials are started (so a run
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may end before ``num_samples``). Set ``patience=1`` to stop as soon
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as a configuration first repeats. Defaults to 5.
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skip_duplicate: If True (default), configurations that have already been
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suggested are skipped instead of re-evaluated. Set to False to allow
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duplicate suggestions (useful for noisy objectives, or to keep
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running until ``num_samples`` is reached).
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analysis: Optionally, the previous analysis to integrate.
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repeat_float_precision: Decimal precision used when hashing float
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values in a config to detect duplicate suggestions. Higher
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values make the duplicate check stricter, so fewer distinct
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configurations are treated as repeats and skipped. Defaults to 5.
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Tune automatically converts search spaces to BayesOptSearch's format:
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.. code-block:: python
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from ray import tune
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from ray.tune.search.bayesopt import BayesOptSearch
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config = {
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"width": tune.uniform(0, 20),
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"height": tune.uniform(-100, 100)
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}
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bayesopt = BayesOptSearch(metric="mean_loss", mode="min")
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tuner = tune.Tuner(
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my_func,
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tune_config=tune.TuneConfig(
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search_alg=baysopt,
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),
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param_space=config,
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)
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tuner.fit()
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If you would like to pass the search space manually, the code would
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look like this:
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.. code-block:: python
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from ray import tune
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from ray.tune.search.bayesopt import BayesOptSearch
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space = {
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'width': (0, 20),
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'height': (-100, 100),
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}
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bayesopt = BayesOptSearch(space, metric="mean_loss", mode="min")
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tuner = tune.Tuner(
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my_func,
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tune_config=tune.TuneConfig(
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search_alg=bayesopt,
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),
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)
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tuner.fit()
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"""
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# bayes_opt.BayesianOptimization: Optimization object
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optimizer = None
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def __init__(
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self,
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space: Optional[Dict] = None,
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metric: Optional[str] = None,
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mode: Optional[str] = None,
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points_to_evaluate: Optional[List[Dict]] = None,
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utility_kwargs: Optional[Dict] = None,
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random_state: int = 42,
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random_search_steps: int = 10,
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verbose: int = 0,
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patience: int = 5,
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skip_duplicate: bool = True,
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analysis: Optional["ExperimentAnalysis"] = None,
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repeat_float_precision: int = 5,
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):
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assert byo is not None, (
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"BayesOpt must be installed!. You can install BayesOpt with"
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" the command: `pip install bayesian-optimization==1.4.3`."
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)
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if mode:
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assert mode in ["min", "max"], "`mode` must be 'min' or 'max'."
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self._config_counter = defaultdict(int)
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self._patience = patience
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if isinstance(repeat_float_precision, bool) or not isinstance(
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repeat_float_precision, int
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):
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raise TypeError("repeat_float_precision must be an integer.")
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if repeat_float_precision < 0:
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raise ValueError("repeat_float_precision must be non-negative.")
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# int: Precision at which to hash float values when checking for
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# duplicate suggestions.
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self.repeat_float_precision = repeat_float_precision
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if self._patience <= 0:
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raise ValueError("patience must be set to a value greater than 0!")
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self._skip_duplicate = skip_duplicate
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# One-time warnings so a converged GP does not fail silently.
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self._logged_duplicate_warning = False
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self._logged_convergence_stop_warning = False
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super(BayesOptSearch, self).__init__(
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metric=metric,
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mode=mode,
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)
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if utility_kwargs is None:
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# The defaults arguments are the same
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# as in the package BayesianOptimization
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utility_kwargs = dict(
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kind="ucb",
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kappa=2.576,
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xi=0.0,
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)
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if mode == "max":
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self._metric_op = 1.0
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elif mode == "min":
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self._metric_op = -1.0
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self._points_to_evaluate = points_to_evaluate
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self._live_trial_mapping = {}
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self._buffered_trial_results = []
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self.random_search_trials = random_search_steps
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self._total_random_search_trials = 0
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self.utility = byo.UtilityFunction(**utility_kwargs)
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self._analysis = analysis
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if isinstance(space, dict) and space:
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resolved_vars, domain_vars, grid_vars = parse_spec_vars(space)
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if domain_vars or grid_vars:
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logger.warning(
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UNRESOLVED_SEARCH_SPACE.format(par="space", cls=type(self))
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)
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space = self.convert_search_space(space, join=True)
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self._space = space
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self._verbose = verbose
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self._random_state = random_state
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self.optimizer = None
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if space:
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self._setup_optimizer()
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def _setup_optimizer(self):
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if self._metric is None and self._mode:
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# If only a mode was passed, use anonymous metric
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self._metric = DEFAULT_METRIC
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self.optimizer = byo.BayesianOptimization(
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f=None,
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pbounds=self._space,
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verbose=self._verbose,
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random_state=self._random_state,
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)
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# Registering the provided analysis, if given
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if self._analysis is not None:
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self.register_analysis(self._analysis)
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def set_search_properties(
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self, metric: Optional[str], mode: Optional[str], config: Dict, **spec
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) -> bool:
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if self.optimizer:
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return False
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space = self.convert_search_space(config)
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self._space = space
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if metric:
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self._metric = metric
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if mode:
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self._mode = mode
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if self._mode == "max":
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self._metric_op = 1.0
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elif self._mode == "min":
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self._metric_op = -1.0
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self._setup_optimizer()
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return True
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def suggest(self, trial_id: str) -> Optional[Dict]:
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"""Return new point to be explored by black box function.
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Args:
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trial_id: Id of the trial.
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This is a short alphanumerical string.
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Returns:
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Either a dictionary describing the new point to explore or
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None, when no new point is to be explored for the time being.
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"""
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if not self.optimizer:
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raise RuntimeError(
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UNDEFINED_SEARCH_SPACE.format(
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cls=self.__class__.__name__, space="space"
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)
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)
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if not self._metric or not self._mode:
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raise RuntimeError(
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UNDEFINED_METRIC_MODE.format(
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cls=self.__class__.__name__, metric=self._metric, mode=self._mode
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)
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)
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if self._points_to_evaluate:
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config = self._points_to_evaluate.pop(0)
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else:
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# We compute the new point to explore
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config = self.optimizer.suggest(self.utility)
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config_hash = _dict_hash(config, self.repeat_float_precision)
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# Check if already computed
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already_seen = config_hash in self._config_counter
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self._config_counter[config_hash] += 1
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top_repeats = max(self._config_counter.values())
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# If patience is set and we've repeated a trial numerous times,
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# we terminate the experiment.
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if self._patience is not None and top_repeats > self._patience:
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if not self._logged_convergence_stop_warning:
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logger.warning(
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"BayesOptSearch is stopping early: a configuration was "
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"suggested more than `patience` (%d) times, which usually "
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"means the search has converged. No further trials will be "
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"suggested. To run more trials, increase `patience`, set "
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"`skip_duplicate=False`, or widen the search space."
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% self._patience
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)
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self._logged_convergence_stop_warning = True
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return Searcher.FINISHED
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# If we have seen a value before, we'll skip it.
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if already_seen and self._skip_duplicate:
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if not self._logged_duplicate_warning:
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logger.warning(
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"BayesOptSearch is re-suggesting already-evaluated "
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"configurations (the Gaussian Process has likely "
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"converged). Duplicates are being skipped; if a "
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"configuration repeats more than `patience` (%d) times the "
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"search will stop early. Set `skip_duplicate=False`, "
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"increase `patience`, or widen the search space to keep "
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"exploring." % self._patience
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)
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self._logged_duplicate_warning = True
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logger.info("Skipping duplicated config: {}.".format(config))
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return None
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# If we are still in the random search part and we are waiting for
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# trials to complete
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if len(self._buffered_trial_results) < self.random_search_trials:
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# We check if we have already maxed out the number of requested
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# random search trials
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if self._total_random_search_trials == self.random_search_trials:
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# If so we stop the suggestion and return None
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return None
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# Otherwise we increase the total number of rndom search trials
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if config:
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self._total_random_search_trials += 1
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# Save the new trial to the trial mapping
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self._live_trial_mapping[trial_id] = config
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# Return a deep copy of the mapping
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return unflatten_dict(config)
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def register_analysis(self, analysis: "ExperimentAnalysis"):
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"""Integrate the given analysis into the gaussian process.
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Args:
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analysis: Optionally, the previous analysis
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to integrate.
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"""
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for (_, report), params in zip(
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analysis.dataframe(metric=self._metric, mode=self._mode).iterrows(),
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analysis.get_all_configs().values(),
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):
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# We add the obtained results to the
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# gaussian process optimizer
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self._register_result(params, report)
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def on_trial_complete(
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self, trial_id: str, result: Optional[Dict] = None, error: bool = False
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) -> None:
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"""Notification for the completion of trial.
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Args:
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trial_id: Id of the trial.
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This is a short alphanumerical string.
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result: Dictionary of result.
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May be none when some error occurs.
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error: Boolean representing a previous error state.
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The result should be None when error is True.
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"""
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# We try to get the parameters used for this trial
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params = self._live_trial_mapping.pop(trial_id, None)
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# The results may be None if some exception is raised during the trial.
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# Also, if the parameters are None (were already processed)
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# we interrupt the following procedure.
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# Additionally, if somehow the error is True but
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# the remaining values are not we also block the method
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if result is None or params is None or error:
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return
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# If we don't have to execute some random search steps
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if len(self._buffered_trial_results) >= self.random_search_trials:
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# we simply register the obtained result
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self._register_result(params, result)
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return
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# We store the results into a temporary cache
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self._buffered_trial_results.append((params, result))
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# If the random search finished,
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# we update the BO with all the computer points.
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if len(self._buffered_trial_results) == self.random_search_trials:
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for params, result in self._buffered_trial_results:
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self._register_result(params, result)
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def _register_result(self, params: Tuple[str], result: Dict):
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"""Register given tuple of params and results."""
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if is_nan_or_inf(result[self.metric]):
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return
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self.optimizer.register(params, self._metric_op * result[self.metric])
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def get_state(self) -> Dict[str, Any]:
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state = self.__dict__.copy()
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return state
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def set_state(self, state: Dict[str, Any]):
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self.__dict__.update(state)
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def save(self, checkpoint_path: str):
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"""Storing current optimizer state."""
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save_object = self.get_state()
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with open(checkpoint_path, "wb") as f:
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pickle.dump(save_object, f)
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def restore(self, checkpoint_path: str):
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"""Restoring current optimizer state."""
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with open(checkpoint_path, "rb") as f:
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save_object = pickle.load(f)
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if isinstance(save_object, dict):
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self.set_state(save_object)
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else:
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# Backwards compatibility
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(
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self.optimizer,
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self._buffered_trial_results,
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self._total_random_search_trials,
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self._config_counter,
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self._points_to_evaluate,
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) = save_object
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@staticmethod
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def convert_search_space(spec: Dict, join: bool = False) -> Dict:
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resolved_vars, domain_vars, grid_vars = parse_spec_vars(spec)
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if grid_vars:
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raise ValueError(
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"Grid search parameters cannot be automatically converted "
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"to a BayesOpt search space."
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)
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# Flatten and resolve again after checking for grid search.
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spec = flatten_dict(spec, prevent_delimiter=True)
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resolved_vars, domain_vars, grid_vars = parse_spec_vars(spec)
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def resolve_value(domain: Domain) -> Tuple[float, float]:
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sampler = domain.get_sampler()
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if isinstance(sampler, Quantized):
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logger.warning(
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"BayesOpt search does not support quantization. "
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"Dropped quantization."
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)
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sampler = sampler.get_sampler()
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if isinstance(domain, Float):
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if domain.sampler is not None and not isinstance(
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domain.sampler, Uniform
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):
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logger.warning(
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"BayesOpt does not support specific sampling methods. "
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"The {} sampler will be dropped.".format(sampler)
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)
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return (domain.lower, domain.upper)
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raise ValueError(
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"BayesOpt does not support parameters of type "
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"`{}`".format(type(domain).__name__)
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)
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# Parameter name is e.g. "a/b/c" for nested dicts
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bounds = {"/".join(path): resolve_value(domain) for path, domain in domain_vars}
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if join:
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spec.update(bounds)
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bounds = spec
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return bounds
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