Source code for immuneML.reports.train_ml_model_reports.CVFeaturePerformance

import warnings
from pathlib import Path
from typing import Tuple, List

import numpy as np
import pandas as pd
import plotly.graph_objects as go

from immuneML.environment.Label import Label
from immuneML.hyperparameter_optimization.states.TrainMLModelState import TrainMLModelState
from immuneML.reports.ReportOutput import ReportOutput
from immuneML.reports.ReportResult import ReportResult
from immuneML.reports.train_ml_model_reports.TrainMLModelReport import TrainMLModelReport
from immuneML.util.PathBuilder import PathBuilder


[docs] class CVFeaturePerformance(TrainMLModelReport): """ This report plots the average training vs test performance w.r.t. given encoding parameter which is explicitly set in the feature attribute. It can be used only in combination with TrainMLModel instruction and can be only specified under 'reports' **Specification arguments:** - feature: name of the encoder parameter w.r.t. which the performance across training and test will be shown. Possible values depend on the encoder on which it is used. - is_feature_axis_categorical (bool): if the x-axis of the plot where features are shown should be categorical; alternatively it is automatically determined based on the feature values **YAML specification:** .. indent with spaces .. code-block:: yaml definitions: reports: report1: CVFeaturePerformance: feature: p_value_threshold # parameter value of SequenceAbundance encoder is_feature_axis_categorical: True # show x-axis as categorical """
[docs] @classmethod def build_object(cls, **kwargs): return CVFeaturePerformance(**kwargs)
def __init__(self, feature: str = None, state: TrainMLModelState = None, result_path: Path = None, label: Label = None, name: str = None, is_feature_axis_categorical: bool = None, number_of_processes: int = 1): super().__init__(name=name, state=state, label=label, result_path=result_path, number_of_processes=number_of_processes) self.feature = feature self.relevant_hp_settings = [] self.feature_values = None self.feature_count = None self.result_name = None self.is_feature_axis_categorical = is_feature_axis_categorical
[docs] def check_prerequisites(self): self._extract_label() if self.label is None: warnings.warn("CVFeaturePerformance: the label was not set for this report and it could not be inferred from the instruction " "as there might be multiple labels there. Skipping the report.", RuntimeWarning) return False self._extract_hp_settings() if self.feature_count != len(self.relevant_hp_settings): warnings.warn(f"CVFeaturePerformance: there are multiple hyperparameter settings with the same value of the " f"feature {self.feature}. Skipping the report...", RuntimeWarning) return False return True
def _extract_label(self): if self.label is None and len(self.state.label_configuration.get_label_objects()) == 1: self.label = self.state.label_configuration.get_label_objects()[0] def _extract_hp_settings(self): self.relevant_hp_settings = [hp_setting for hp_setting in self.state.hp_settings if self.feature in hp_setting.encoder_params] self.feature_values = np.unique([hp_setting.encoder_params[self.feature] for hp_setting in self.relevant_hp_settings]) self.feature_count = len(self.feature_values) def _generate(self) -> ReportResult: PathBuilder.build(self.result_path) self.result_name = f"{self.feature}_performance" training_dataframe, test_dataframe = self._make_plot_dataframes() table_results = self._store_dataframes(training_dataframe, test_dataframe) report_output_fig = self._plot(training_dataframe=training_dataframe, test_dataframe=test_dataframe) output_figures = None if report_output_fig is None else [report_output_fig] return ReportResult(name=self.name, info=f"The average training vs test performance w.r.t. the given encoding parameter {self.feature}.", output_tables=table_results, output_figures=output_figures) def _plot(self, training_dataframe, test_dataframe): optimization_metric = self.state.optimization_metric.name.lower() fig = go.Figure() fig.add_trace(go.Scatter(x=training_dataframe["x"], y=training_dataframe["y"], name="training", mode="markers", marker_size=11, marker_color="#CC79A7", hovertemplate=f"training {optimization_metric}" + ": %{y}<extra></extra>", opacity=0.8)) fig.add_trace(go.Scatter(x=test_dataframe["x"], y=test_dataframe["y"], name="test", mode="markers", marker_size=11, marker_color="#009E73", hovertemplate=f"test {optimization_metric}" + ": %{y}<extra></extra>", opacity=0.8)) fig.update_layout(legend_title_text="Data", title="Performance across feature values", template="plotly_white") fig.update_xaxes(title_text=self.feature) if self.is_feature_axis_categorical: fig.update_xaxes(type='category') fig.update_yaxes(title_text=f"performance ({self.state.optimization_metric.name.lower()})") fig.update_layout(hovermode="x unified") file_path = self.result_path / f"{self.result_name}.html" fig.write_html(str(file_path)) return ReportOutput(path=file_path) def _store_dataframes(self, training_dataframe: pd.DataFrame, test_dataframe: pd.DataFrame) -> List[ReportOutput]: train_path = self.result_path / "training_performance.csv" test_path = self.result_path / "test_performance.csv" training_dataframe.to_csv(train_path, index=False) test_dataframe.to_csv(test_path, index=False) return [ReportOutput(path=train_path, name=f"Training performance w.r.t. {self.feature} values"), ReportOutput(path=test_path, name=f"Test performance w.r.t. {self.feature} values")] def _make_plot_dataframes(self) -> Tuple[pd.DataFrame, pd.DataFrame]: performance_training = np.zeros((self.feature_count, self.state.assessment.split_count, self.state.selection.split_count)) features_test = np.zeros((self.state.assessment.split_count, self.feature_count)) performance_test = np.zeros((self.state.assessment.split_count, self.feature_count)) for assessment_split_index, assessment_state in enumerate(self.state.assessment_states): assessment_items = [assessment_state.label_states[self.label.name].assessment_items[hp_setting.get_key()] for hp_setting in self.relevant_hp_settings] features_test[assessment_split_index] = [item.hp_setting.encoder_params[self.feature] for item in assessment_items] performance_test[assessment_split_index] = [item.performance[self.state.optimization_metric.name.lower()] for item in assessment_items] for hp_index, hp_setting in enumerate(self.relevant_hp_settings): performance_training[hp_index, assessment_split_index] = \ [item.performance[self.state.optimization_metric.name.lower()] for item in assessment_state.label_states[self.label.name].selection_state.hp_items[hp_setting.get_key()]] feature_values = self.feature_values.astype(str) test_dataframe = pd.DataFrame({"x": feature_values, "y": performance_test.mean(axis=0)}) training_dataframe = pd.DataFrame({"x": feature_values, "y": performance_training.mean(axis=(1, 2))}) return training_dataframe, test_dataframe