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machinelearning-classification - Classification based on machine learning using scikit-learn

Clinica provides a modular way to perform classification based on machine learning. To build its own classification pipeline, the user can combine three modules based on scikit-learn [Pedregosa et al., 2011]:

  • Input (e.g. gray matter maps obtained from T1-weighted MR images, FDG PET images)
  • Algorithm (e.g. support vector machine, logistic regression, random forest)
  • Validation (e.g. K-fold cross validation, repeated K-fold cross validation, repeated hold-out validation)

This combination of modules is wrapped into the machinelearning-classification command line interface with default values [Samper et al., 2018] for algorithm and validation modules. If you want to fine tune these parameters or create your own module(s), please refer to the Going further section.

Prerequisites

You need to have performed the t1-volume pipeline on your T1-weighted MR images and/or the pet-volume pipeline on your PET images.

Dependencies

If you installed the core of Clinica, this pipeline needs no further dependencies.

Running the pipeline

The pipeline can be run with the following command line:

clinica run machine-learning-classification [OPTIONS] CAPS_DIRECTORY GROUP_LABEL {VoxelBased|RegionBased} {T1w|PET}
                                            {DualSVM|LogisticRegression|RandomForest} {RepeatedHoldOut|RepeatedKFoldCV} SUBJECTS_VISITS_TSV
                                            DIAGNOSES_TSV OUTPUT_DIRECTORY

where:

  • CAPS_DIRECTORY is the folder containing the results of the t1-volume and/or the pet-volume pipeline.
  • GROUP_LABEL is a string defining the group label for the current analysis, which helps you keep track of different analyses.
  • The third positional argument defines the type of features for classification. It can be:
    • RegionBased: a list of values stored in a TSV file is used as features. This list corresponds to PET or T1 image intensities averaged over a set of regions obtained from a brain parcellation when running the t1-volume and/or pet-volume pipeline.
    • VoxelBased: all the voxels of the image are used as features.
  • The fourth positional argument defines the studied modality (T1w or PET).
  • The fifth positional argument defines the algorithm. It can be:
    • DualSVM: support vector machine (SVM) algorithm
    • LogisticRegression: logistic regression algorithm
    • RandomForest: random forest algorithm
  • The sixth positional argument defines the validation method. It can be:
    • RepeatedHoldOut: repeated hold-out validation
    • RepeatedKFoldCV: repeated K-fold cross validation
  • SUBJECTS_VISITS_TSV is a TSV file containing the participant_id and the session_id columns.
  • DIAGNOSES_TSV is a TSV file where the diagnosis for each participant (identified by a participant ID) is reported (e.g. AD, CN). It allows the algorithm to perform the dual classification (between the two labels reported). Example of a diagnosis TSV file:
participant_id    diagnosis
sub-CLNC0001      AD
sub-CLNC0002      CN
sub-CLNC0003      AD
sub-CLNC0004      AD
sub-CLNC0005      CN
  • OUTPUT_DIRECTORY: the directory where outputs are saved.

Pipeline options if you use region-based inputs:

  • --atlas: Name of the atlas used for the brain parcellation generated by the t1-volume and/or the pet-volume pipeline. It can be AAL2, AICHA, Hammers, LPBA40 or Neuromorphometrics described here.

Pipeline options if you specified PET inputs:

  • --acq_label: Name of the label given to the PET acquisition, specifying the tracer used (trc-<acq_label>).
  • --suvr_reference_region: Reference region used to perform intensity normalization (i.e. dividing each voxel of the image by the average uptake in this region) resulting in a standardized uptake value ratio (SUVR) map. It can be cerebellumPons (used for amyloid tracers) or pons (used for FDG).

Output

Results are saved in the output folder following this hierarchy:

└── <image-type>
    ├── region_based
    |    └── atlas-<atlas-id>
    |        └── <machine-learning-algorithm>
    |             └── <task1>_vs_<task2>
    |                 ├── classifier
    |                 |    └── iteration-<iteration-number>
    |                 |        ├── mean_results.tsv
    |                 |        ├── results.tsv
    |                 |        └── subjects.tsv
    |                 ├── best_parameters.json
    |                 ├── dual_coefficients.txt
    |                 ├── intersect.txt
    |                 ├── support_vector_indices.json
    |                 ├── weights.nii.gz
    |                 └── weights.txt
    └── voxel_based
        └── smoothing-<fwhm>
            └── <machine-learning-algorithm>
                └── <task1>_vs_<task2>
                    ├── classifier
                    |    └── iteration-<number-iteration>
                    |        ├── mean_results.tsv
                    |        ├── results.tsv
                    |        └── subjects.tsv
                    ├── best_parameters.json
                    ├── dual_coefficients.txt
                    ├── intersect.txt
                    ├── support_vector_indices.json
                    ├── weights.nii.gz
                    └── weights.txt

If image_type is PET:

└── <image-type>
    └── region_based/voxel_base
        └── pvc-<pvc>
            └── ...

Going further

Fine tune algorithm and validation parameters

The machinelearning-classification command uses sensible default options (defined in ml_workflows.py) that were used for classification of patients with Alzheimer’s disease [Samper et al., 2018].

No matter the combination of modules chosen, the algorithm and validation parameters are:

  • fwhm: the FWHM value in mm used in the t1-volume and/or the pet-volume pipeline
  • modulated: a flag to indicate if, when running the t1-volume pipeline, the image has been modulated or not (on, off)
  • use_pvc_data: use PET data with partial value correction (True/False). By default, PET data with no PVC are used.
  • precomputed_kernel: to load the precomputed kernel if it exists
  • mask_zeros: a flag to indicate if zero-valued voxels should be taken into account for the classification (True/False)
  • n_iterations: number of times a task is repeated
  • grid_search_folds: number of folds to use for the hyperparameter grid search (e.g. 10)
  • c_range: range used to select the best value for the C parameter, in the logspace
  • test_size: percentage (between 0 and 1) representing the size of the test set for each shuffle split
  • balanced: option to balance the weights according to the number of samples
  • penalty: type of penalty (l2 or l1)

Create or combine a set of modules

Tip

Usage examples are available in ml_workflows.py.

Input

Two classes corresponding to the voxel-based and the region-based approaches are implemented in input.py:

  • CAPSRegionBasedInput: a list of values stored in a TSV file is used as features. This list corresponds to PET or T1 image intensities averaged over a set of regions obtained from a brain parcellation when running the t1-volume and/or pet-volume pipeline.
  • CAPSVoxelBasedInput: all the voxels of the image are used as features.

Note

The atlases that can be used for the region-based approaches are listed here.

Algorithm

Three classes corresponding to the machine learning-based classification algorithms are implemented in algorithm.py:

  • DualSVMAlgorithm: support vector machine (SVM) algorithm (input: all the data available or a kernel that can be pre-computed)
  • LogisticReg: logistic regression algorithm (input: all the data available)
  • RandomForest: random forest algorithm (input: all the data available)

Each algorithm implements a grid search approach to choose the best parameters for the classification by looking at the value of the balanced accuracy. The area under the receiver operating characteristic (ROC) curve (AUC) is also reported. The labels are automatically assigned based on the DIAGNOSES_TSV file.

Validation

Three classes corresponding to the validation strategies are implemented in validation.py:

  • KFoldCV: K-fold cross validation
  • RepeatedKFoldCV: repeated K-fold cross validation
  • RepeatedHoldOut: repeated hold-out validation

The input is the name of the classification algorithm used.

Describing this pipeline in your paper

Example of paragraph:

These results have been obtained using the machine learning-based classification modules of Clinica [Routier et al., 2021; Samper et al., 2018]. Clinica provides a modular way to perform classification based on machine learning by combining different inputs (e.g. gray matter maps obtained from T1-weighted MR images, FDG PET images), algorithms (e.g. support vector machine, logistic regression, random forest) and validation strategies (e.g. K-fold cross validation, repeated K-fold cross validation, repeated hold-out validation). These modules rely on scikit-learn [Pedregosa et al., 2011].

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