view ludwig_hyperopt.xml @ 5:8f74efef9882 draft default tip

planemo upload for repository https://github.com/goeckslab/Galaxy-Ludwig.git commit 157a73c006785cd373d41578001b32a8cf9ebdeb
author goeckslab
date Wed, 27 Aug 2025 20:29:32 +0000
parents fed9b5eaa829
children
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<tool id="ludwig_hyperopt" name="Ludwig Hyperopt" version="@VERSION@" profile="@PROFILE@">
    <description>searches for optimal Hyperparameters</description>
    <macros>
        <import>ludwig_macros.xml</import>
    </macros>
    <expand macro="python_requirements_gpu" />
    <required_files>
        <include path="utils.py" />
        <include path="ludwig_experiment.py" />
        <include path="ludwig_hyperopt.py" />
    </required_files>
    <expand macro="macro_stdio" />
    <version_command>echo "@VERSION@"</version_command>
    <command>
        <![CDATA[
            TMPDIR='/tmp';
            TMP=\$TMPDIR;
            TEMP=\$TMPDIR;
            export TMPDIR TMP TEMP &&
            #import re
            #if $config
            cp '$config' "./config.yml";
            #end if

            #if $dataset
            #set $sanitized_dataset = re.sub('[^\w\-_\.]', '_', $dataset.element_identifier.strip())
            ln -sf '$dataset' "./${sanitized_dataset}";
            #end if

            #if $training_set
            #set $sanitized_training_set = re.sub('[^\w\-_\.]', '_', $training_set.element_identifier.strip())
            ln -sf '$training_set' "./${sanitized_training_set}";
            #end if

            #if $validation_set
            #set $sanitized_validation_set = re.sub('[^\w\-_\.]', '_', $validation_set.element_identifier.strip())
            ln -sf '$validation_set' "./${sanitized_validation_set}";
            #end if

            #if $test_set
            #set $sanitized_test_set = re.sub('[^\w\-_\.]', '_', $test_set.element_identifier.strip())
            ln -sf '$test_set' "./${sanitized_test_set}";
            #end if

            #if $raw_data
                unzip -o -q '$raw_data' -d ./;
            #end if

            python '$__tool_directory__/ludwig_hyperopt.py'
                #if $config
                --config "./config.yml"
                #end if
                #if $model_load_path
                --model_load_path '$model_load_path.extra_files_path'
                #end if
                #if $dataset
                --dataset "./${sanitized_dataset}"
                #end if
                #if $training_set
                --training_set "./${sanitized_training_set}"
                #end if
                #if $validation_set
                --validation_set "./${sanitized_validation_set}"
                #end if
                #if $test_set
                --test_set "./${sanitized_test_set}"
                #end if
                #if $training_set_metadata
                --training_set_metadata '$training_set_metadata'
                #end if
                ## #if not $save_model
                ## --skip_save_model
                ## #end if
                --output_directory "."
                --data_format '$data_format'
                --random_seed $random_seed
                --backend local
                --skip_save_progress &&

            hyperopt_stats_path='hyperopt_statistics.json' &&
            mkdir -p '$output_hyperopt.extra_files_path' &&
            cp "hyperopt/\$hyperopt_stats_path" '$output_hyperopt.extra_files_path' &&
            cp -r visualizations '$output_hyperopt.extra_files_path' &&
            best_trial=\$(cat ../outputs/tool_stdout | grep "^Current best trial:" | tail -1 | cut -d" " -f 4) &&
            mkdir -p '$output_model.extra_files_path' &&
            cp hyperopt/trial_\$best_trial/hyperopt_run/model/*.json hyperopt/trial_\$best_trial/hyperopt_run/model/model_weights '$output_model.extra_files_path'
        ]]>
    </command>
    <configfiles>
        <inputs name="inputs" />
    </configfiles>
    <inputs>
        <param name="config" type="data" format="yaml" label="Select the dataset containing model configuration" />
        <param name="model_load_path" type="data" format="ludwig_model" optional="true" label="Load a pretrained model as initialization" help="Optional." />
        <param name="dataset" type="data" format="tabular,csv,h5,json,txt" optional="true" label="Input dataset" />
        <param name="training_set" type="data" format="tabular,csv,h5,json" optional="true" label="Input traning dataset" />
        <param name="validation_set" type="data" format="tabular,csv,h5,json" optional="true" label="Input validation dataset" />
        <param name="test_set" type="data" format="tabular,csv,h5,json" optional="true" label="Input test dataset" />
        <param name="training_set_metadata" type="data" format="json" optional="true" label="Training set metadata" />
        <param name="data_format" type="select" label="Data format">
            <option value="auto" selected="true">auto</option>
            <option value="tsv">tsv</option>
            <option value="csv">csv</option>
            <option value="h5">h5</option>
            <option value="json">json</option>
        </param>
        <param name="random_seed" type="integer" value="42" label="Randomness seed" min="0" max="999999" />
        <!-- <param name="save_model" type="boolean" checked="true" label="Whether to save model?" /> -->
        <param name="raw_data" type="data" format="zip" optional="true" label="Raw data" help="Optional. Needed for images."/>
    </inputs>       
    <outputs>
        <data format="ludwig_model" name="output_model" label="${tool.name} best model files on ${on_string}" >
        </data>
        <data format="html" name="output_hyperopt" from_work_dir="ludwig_hyperopt_report.html" label="${tool.name} report on ${on_string}" />
        <data format="json" name="output_hyperopt_stats" from_work_dir="hyperopt/hyperopt_statistics.json" label="${tool.name} statistics on ${on_string}" />
    </outputs>
    <tests>
        <test>
            <param name="dataset" value="temperature_la.csv" ftype="csv" />
            <param name="config" value="temperature_hyperopt.yml" ftype="yaml" />
            <param name="data_format" value="csv" />
            <output name="output_hyperopt" file="ludwig_hyperopt_report_test.html" compare="sim_size" delta="20000" >
                <assert_contents>
                    <has_text text="Hyperopt" />
                </assert_contents>
            </output>
        </test>
    </tests>
    <help>
        <![CDATA[
            **What it does**
            Hyperparameter tuning.

            **Input**

            **Output**

            - Hyperopt report
            - The best Ludwig model

        ]]>
    </help>
    <expand macro="macro_citations" />
</tool>