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410 lines
16 KiB
Markdown
410 lines
16 KiB
Markdown
## `LogisticRegression`
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The `LogisticRegression` class implements a simple L2-regularized two-class
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logistic regression classifier for numerical data, by default using L-BFGS to
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learn the model. The class offers easy configurability, and arbitrary
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optimizers can be used to learn the model.
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Logistic regression is useful for two-class classification (i.e. classes are `0`
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or `1`). For multi-class logistic regression, see
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[`SoftmaxRegression`](softmax_regression.md).
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#### Simple usage example:
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```c++
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// Train a logistic regression model on random data and predict labels:
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// All data and labels are uniform random; 5 dimensional data, 2 classes.
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// Replace with a data::Load() call or similar for a real application.
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arma::mat dataset(5, 1000, arma::fill::randu); // 1000 points.
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arma::Row<size_t> labels =
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arma::randi<arma::Row<size_t>>(1000, arma::distr_param(0, 1));
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arma::mat testDataset(5, 500, arma::fill::randu); // 500 test points.
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mlpack::LogisticRegression lr; // Step 1: create model.
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lr.Train(dataset, labels); // Step 2: train model.
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arma::Row<size_t> predictions;
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lr.Classify(testDataset, predictions); // Step 3: classify points.
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// Print some information about the test predictions.
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std::cout << arma::accu(predictions == 0) << " test points classified as class "
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<< "0." << std::endl;
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```
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<p style="text-align: center; font-size: 85%"><a href="#simple-examples">More examples...</a></p>
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#### Quick links:
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* [Constructors](#constructors): create `LogisticRegression` objects.
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* [`Train()`](#training): train model.
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* [`Classify()`](#classification): classify with a trained model.
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* [Other functionality](#other-functionality) for loading, saving, and
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inspecting.
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* [Examples](#simple-examples) of simple usage and links to detailed example
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projects.
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* [Template parameters](#advanced-functionality-different-element-types) for
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using different element types for a model.
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#### See also:
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* [`SoftmaxRegression`](softmax_regression.md)
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* [mlpack classifiers](../modeling.md#classification)
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* [Logistic regression on Wikipedia](https://en.wikipedia.org/wiki/Logistic_regression)
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### Constructors
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* `lr = LogisticRegression()`
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- Initialize the model without training.
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- You will need to call [`Train()`](#training) later to train the model
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before calling [`Classify()`](#classification).
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---
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* `lr = LogisticRegression(data, labels, lambda=0.0, [callbacks...])`
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* `lr = LogisticRegression(data, labels, initialPoint, lambda=0.0, [callbacks...])`
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- Train model, optionally specifying an initial set of weights for the
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optimization and callbacks.
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---
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* `lr = LogisticRegression(data, labels, optimizer, lambda=0.0, [callbacks...])`
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* `lr = LogisticRegression(data, labels, optimizer, initialPoint, lambda=0.0, [callbacks...])`
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- Train model with a custom ensmallen optimizer, optionally specifying an
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initial set of weights to start the optimization from and callbacks for the
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optimizer.
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---
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#### Constructor Parameters:
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| **name** | **type** | **description** | **default** |
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|----------|----------|-----------------|-------------|
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| `data` | [`arma::mat`](../matrices.md) | [Column-major](../matrices.md#representing-data-in-mlpack) training matrix. | _(N/A)_ |
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| `labels` | [`arma::Row<size_t>`](../matrices.md) | Training labels, either [`0` or `1`](../core/normalizing_labels.md). Should have length `data.n_cols`. | _(N/A)_ |
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| `initialPoint` | `arma::rowvec` | Initial model weights to start optimization from. Should have length `data.n_rows + 1`. The first element is the bias. If not specified, a zero vector will be used. | zero vector |
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| `optimizer` | [any ensmallen optimizer](https://www.ensmallen.org) | Instantiated ensmallen optimizer for [differentiable functions](https://www.ensmallen.org/docs.html#differentiable-functions) or [differentiable separable functions](https://www.ensmallen.org/docs.html#differentiable-separable-functions). | `ens::L_BFGS()` |
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| `lambda` | `double` | L2 regularization penalty parameter. Must be nonnegative. | `0.0` |
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| `callbacks...` | [any set of ensmallen callbacks](https://www.ensmallen.org/docs.html#callback-documentation) | Optional callbacks for the ensmallen optimizer, such as e.g. `ens::ProgressBar()`, `ens::Report()`, or others. | _(N/A)_ |
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As an alternative to passing `lambda` or `initialPoint`, these can be set with a
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standalone method. The following functions can be used before calling
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`Train()`:
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* `lr.Lambda() = l;` will set the value of the L2 regularization penalty
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parameter to `l`.
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* `lr.Parameters() = initialPoint;` will set the initial point for the training
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optimization to `initialPoint`.
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***Note***: Setting `lambda` too small may cause the model to overfit; however,
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setting it too large may cause the model to underfit. [Automatic hyperparameter
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tuning](../hpt.md) can be used to find a good value of `lambda` instead of a
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manual setting.
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<!-- TODO: fix link for hyperparameter tuner -->
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### Training
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If training is not done as part of the constructor call, it can be done with one
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of the following versions of the `Train()` member function:
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* `lr.Train(data, labels)`
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* `lr.Train(data, labels, lambda=0.0, [callbacks...])`
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- Train model, optionally specifying callbacks for the default L-BFGS
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optimizer.
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---
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* `lr.Train(data, labels, optimizer)`
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* `lr.Train(data, labels, optimizer, lambda=0.0, [callbacks...])`
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- Train model with a custom ensmallen optimizer, optionally specifying
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callbacks.
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---
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Types of each argument are the same as in the table for constructors
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[above](#constructor-parameters).
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***Notes***:
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* Training is incremental. Successive calls to `Train()` will not reinitialize
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the model, unless the given data has different dimensionality. To
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reinitialize the model, call `Reset()` (see
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[Other Functionality](#other-functionality)).
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* To set the initial point of the optimization, call `Parameters()`; see
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[Other Functionality](#other-functionality).
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* `Train()` returns a `double` with the final logistic regression loss value
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(including L2 penalty term) of the trained model.
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### Classification
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Once a `LogisticRegression` model is trained, the `Classify()` member function
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can be used to make class predictions for new data.
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* `size_t predictedClass = lr.Classify(point, decisionBoundary=0.5)`
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- ***(Single-point)***
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- Classify a single point, returning the predicted class (`0` or `1`).
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---
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* `lr.Classify(point, prediction, probabilitiesVec, decisionBoundary=0.5)`
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- ***(Single-point)***
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- Classify a single point and compute class probabilities.
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- The predicted class is stored in `prediction`.
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- The probability of class `i` can be accessed with `probabilitiesVec[i]`.
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---
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* `lr.Classify(data, predictions, decisionBoundary=0.5)`
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- ***(Multi-point)***
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- Classify a set of points.
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- The prediction for data point `i` can be accessed with `predictions[i]`.
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---
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* `lr.Classify(data, predictions, probabilities, decisionBoundary=0.5)`
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- ***(Multi-point)***
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- Classify a set of points and compute class probabilities.
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- The prediction for data point `i` can be accessed with `predictions[i]`.
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- The probability of class `j` for data point `i` can be accessed with
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`probabilities(j, i)`.
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---
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#### Classification Parameters:
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| **usage** | **name** | **type** | **description** |
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|-----------|----------|----------|-----------------|
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| _single-point_ | `point` | [`arma::vec`](../matrices.md) | Single point for classification. |
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| _single-point_ | `prediction` | `size_t&` | `size_t` to store class prediction into. |
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| _single-point_ | `probabilitiesVec` | [`arma::vec&`](../matrices.md) | `arma::vec&` to store class probabilities into; will have length 2. |
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| _multi-point_ | `data` | [`arma::mat`](../matrices.md) | Set of [column-major](../matrices.md#representing-data-in-mlpack) points for classification. |
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| _multi-point_ | `predictions` | [`arma::Row<size_t>&`](../matrices.md) | Vector of `size_t`s to store class prediction into; will be set to length `data.n_cols`. |
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| _multi-point_ | `probabilities` | [`arma::mat&`](../matrices.md) | Matrix to store class probabilities into (number of rows will be equal to 2; number of columns will be equal to `data.n_cols`). |
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| _all_ | `decisionBoundary` | `double` | If the logistic function value for a point is greater than `decisionBoundary`, it is classified as class `1`. Defaults to `0.5`. |
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### Other Functionality
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* A `LogisticRegression` model can be serialized with
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[`data::Save()` and `data::Load()`](../load_save.md#mlpack-objects).
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* `lr.Parameters()` will return an `arma::rowvec` filled with the weights of
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the model. This vector has length equal to the dimensionality plus one, and
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the first element is the bias.
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* `lr.Lambda()` will return the L2 regularization penalty parameter.
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* `lr.ComputeAccuracy(data, labels, decisionBoundary=0.5)` will return the
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accuracy of the model on the given `data` with the given `labels`. The
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returned accuracy is between 0 and 100.
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* `lr.ComputeError(data, labels)` will return the loss of the logistic
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regression objective function on the given `data` with the given `labels`.
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* `lr.Reset()` will reset the weights of the model to zeros.
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For complete functionality, the [source
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code](/src/mlpack/methods/logistic_regression/logistic_regression.hpp) can be
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consulted. Each method is fully documented.
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### Simple Examples
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See also the [simple usage example](#simple-usage-example) for a trivial usage
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of the `LogisticRegression` class.
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---
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Train a logistic regression model using a custom SGD-like optimizer with
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callbacks.
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```c++
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// See https://datasets.mlpack.org/satellite.train.csv.
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arma::mat dataset;
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mlpack::data::Load("satellite.train.csv", dataset, true);
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// See https://datasets.mlpack.org/satellite.train.labels.csv.
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arma::Row<size_t> labels;
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mlpack::data::Load("satellite.train.labels.csv", labels, true);
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mlpack::LogisticRegression lr;
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lr.Lambda() = 0.1;
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// Create AMSGrad optimizer with custom step size and batch size.
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ens::AMSGrad optimizer(0.01 /* step size */, 16 /* batch size */);
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optimizer.MaxIterations() = 100 * dataset.n_cols; // Allow 100 epochs.
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// Print a progress bar and an optimization report when training is finished.
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lr.Train(dataset, labels, optimizer, ens::ProgressBar(), ens::Report());
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// Now predict on test labels and compute accuracy.
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// See https://datasets.mlpack.org/satellite.test.csv.
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arma::mat testDataset;
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mlpack::data::Load("satellite.test.csv", testDataset, true);
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// See https://datasets.mlpack.org/satellite.test.labels.csv.
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arma::Row<size_t> testLabels;
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mlpack::data::Load("satellite.test.labels.csv", testLabels, true);
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std::cout << std::endl;
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std::cout << "Accuracy on training set: "
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<< lr.ComputeAccuracy(dataset, labels) << "\%." << std::endl;
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std::cout << "Accuracy on test set: "
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<< lr.ComputeAccuracy(testDataset, testLabels) << "\%." << std::endl;
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std::cout << "Objective on training set: "
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<< lr.ComputeError(dataset, labels) << "." << std::endl;
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std::cout << "Objective on test set: "
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<< lr.ComputeError(testDataset, testLabels) << "." << std::endl;
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```
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---
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Train a logistic regression model with SGD and save the model every epoch using
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a [custom ensmallen
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callback](https://www.ensmallen.org/docs.html#custom-callbacks):
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```c++
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// This callback saves the model into "model-<epoch>.bin" after every epoch.
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class ModelCheckpoint
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{
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public:
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ModelCheckpoint(mlpack::LogisticRegression<>& model) : model(model) { }
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template<typename OptimizerType, typename FunctionType, typename MatType>
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bool EndEpoch(OptimizerType& /* optimizer */,
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FunctionType& /* function */,
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const MatType& /* coordinates */,
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const size_t epoch,
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const double /* objective */)
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{
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const std::string filename = "model-" + std::to_string(epoch) + ".bin";
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mlpack::data::Save(filename, "lr_model", model, true);
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return false; // Do not terminate the optimization.
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}
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private:
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mlpack::LogisticRegression<>& model;
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};
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```
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With that callback available, the code to train the model is below:
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```c++
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// See https://datasets.mlpack.org/satellite.train.csv.
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arma::mat dataset;
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mlpack::data::Load("satellite.train.csv", dataset, true);
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// See https://datasets.mlpack.org/satellite.train.labels.csv.
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arma::Row<size_t> labels;
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mlpack::data::Load("satellite.train.labels.csv", labels, true);
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mlpack::LogisticRegression lr;
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// Create AdaDelta optimizer with a small step size and batch size of 1.
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ens::AdaDelta adaDelta(0.001, 1);
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adaDelta.MaxIterations() = 100 * dataset.n_cols; // 100 epochs maximum.
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// Use the custom callback and an L2 penalty parameter of 0.01.
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lr.Train(dataset, labels, adaDelta, 0.01, ModelCheckpoint(lr),
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ens::ProgressBar());
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// Now files like model-1.bin, model-2.bin, etc. should be saved on disk.
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```
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---
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Load an existing logistic regression model and print some information about it.
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```c++
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mlpack::LogisticRegression lr;
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// This assumes that a model called "lr_model" has been saved to the file
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// "model-1.bin" (as in the previous example).
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mlpack::data::Load("model-1.bin", "lr_model", lr, true);
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// Print the dimensionality of the model and some other statistics.
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std::cout << "The dimensionality of the model in model-1.bin is "
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<< (lr.Parameters().n_elem - 1) << "." << std::endl;
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std::cout << "The bias parameter for the model is " << lr.Parameters()[0]
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<< "." << std::endl;
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arma::vec point(lr.Parameters().n_elem - 1, arma::fill::randu);
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std::cout << "The predicted class for a random point, using a decision boundary"
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<< " of 0.2, is " << lr.Classify(point, 0.2) << "." << std::endl;
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```
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---
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Perform incremental training on multiple datasets with multiple calls to
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`Train()`.
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```c++
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// Generate two random datasets.
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arma::mat firstDataset(5, 1000, arma::fill::randu); // 1000 points.
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arma::Row<size_t> firstLabels =
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arma::randi<arma::Row<size_t>>(1000, arma::distr_param(0, 1));
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arma::mat secondDataset(5, 1500, arma::fill::randu); // 1500 points.
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arma::Row<size_t> secondLabels =
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arma::randi<arma::Row<size_t>>(1500, arma::distr_param(0, 1));
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// Train a model on the first dataset with an L2 regularization penalty
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// parameter of 0.01.
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mlpack::LogisticRegression lr(firstDataset, firstLabels, 0.01);
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// Now compute the objective on the second dataset and print it.
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std::cout << "Objective on second dataset: "
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<< lr.ComputeError(secondDataset, secondLabels) << "." << std::endl;
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// Train for a second round on the second dataset.
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lr.Train(secondDataset, secondLabels);
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// Now compute the objective on the second dataset again and print it.
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// (Note that it may not be all that much better because this is random data!)
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std::cout << "Objective on second dataset after second training: "
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<< lr.ComputeError(secondDataset, secondLabels) << "." << std::endl;
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```
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---
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### Advanced Functionality: Different Element Types
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The `LogisticRegression` class has one template parameter that can be used to
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control the element type of the model. The full signature of the class is:
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```
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LogisticRegression<MatType>
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```
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`MatType` specifies the type of matrix used for training data and internal
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representation of model parameters. Any matrix type that implements the
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Armadillo API can be used. The example below trains a logistic regression model
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on sparse 32-bit floating point data.
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```c++
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// Create random, sparse 100-dimensional data.
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arma::sp_fmat dataset;
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dataset.sprandu(100, 5000, 0.3);
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arma::Row<size_t> labels =
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arma::randi<arma::Row<size_t>>(5000, arma::distr_param(0, 1));
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// Train with L2 regularization penalty parameter of 0.1.
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mlpack::LogisticRegression<arma::sp_fmat> lr(dataset, labels, 0.1);
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// Now classify a test point.
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arma::sp_fvec point;
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point.sprandu(100, 1, 0.3);
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size_t prediction;
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arma::fvec probabilitiesVec;
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lr.Classify(point, prediction, probabilitiesVec);
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std::cout << "Prediction for random test point: " << prediction << "."
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<< std::endl;
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std::cout << "Class probabilities for random test point: "
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<< probabilitiesVec.t();
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```
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***Note***: if `MatType` is a sparse object (e.g. `sp_fmat`), the internal
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parameter representation will be a *dense* vector containing elements of the
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same type (e.g. `frowvec`). This is because L2-regularized logistic regression,
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even when training on sparse data, does not necessarily produce sparse models.
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