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Mean squared prediction error
Mean squared prediction error
from Wikipedia

In statistics the mean squared prediction error (MSPE), also known as mean squared error of the predictions, of a smoothing, curve fitting, or regression procedure is the expected value of the squared prediction errors (PE), the square difference between the fitted values implied by the predictive function and the values of the (unobservable) true value g. It is an inverse measure of the explanatory power of and can be used in the process of cross-validation of an estimated model. Knowledge of g would be required in order to calculate the MSPE exactly; in practice, MSPE is estimated.[1]

Formulation

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If the smoothing or fitting procedure has projection matrix (i.e., hat matrix) L, which maps the observed values vector to predicted values vector then PE and MSPE are formulated as:

The MSPE can be decomposed into two terms: the squared bias (mean error) of the fitted values and the variance of the fitted values:

The quantity SSPE=nMSPE is called sum squared prediction error. The root mean squared prediction error is the square root of MSPE: RMSPE=MSPE.

Computation of MSPE over out-of-sample data

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The mean squared prediction error can be computed exactly in two contexts. First, with a data sample of length n, the data analyst may run the regression over only q of the data points (with q < n), holding back the other n – q data points with the specific purpose of using them to compute the estimated model’s MSPE out of sample (i.e., not using data that were used in the model estimation process). Since the regression process is tailored to the q in-sample points, normally the in-sample MSPE will be smaller than the out-of-sample one computed over the n – q held-back points. If the increase in the MSPE out of sample compared to in sample is relatively slight, that results in the model being viewed favorably. And if two models are to be compared, the one with the lower MSPE over the n – q out-of-sample data points is viewed more favorably, regardless of the models’ relative in-sample performances. The out-of-sample MSPE in this context is exact for the out-of-sample data points that it was computed over, but is merely an estimate of the model’s MSPE for the mostly unobserved population from which the data were drawn.

Second, as time goes on more data may become available to the data analyst, and then the MSPE can be computed over these new data.

Estimation of MSPE over the population

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When the model has been estimated over all available data with none held back, the MSPE of the model over the entire population of mostly unobserved data can be estimated as follows.

For the model where , one may write

Using in-sample data values, the first term on the right side is equivalent to

Thus,

If is known or well-estimated by , it becomes possible to estimate MSPE by

Colin Mallows advocated this method in the construction of his model selection statistic Cp, which is a normalized version of the estimated MSPE:

where p the number of estimated parameters p and is computed from the version of the model that includes all possible regressors. That concludes this proof.

See also

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References

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Revisions and contributorsEdit on WikipediaRead on Wikipedia
from Grokipedia
The mean squared prediction error (MSPE) is a fundamental statistical metric used to evaluate the predictive accuracy of a model by quantifying the expected squared difference between actual outcomes and model predictions for new, unseen . Formally, it is defined as E[(YY^)2]\mathbb{E}[(Y - \hat{Y})^2], where YY represents the true value and Y^\hat{Y} the predicted value, with the expectation taken over the distribution of inputs and outputs. This measure emphasizes out-of-sample performance, distinguishing it from in-sample error estimates that may overestimate accuracy due to . In practice, MSPE is estimated using a test dataset by averaging the squared residuals: 1ni=1n(yiy^i)2\frac{1}{n} \sum_{i=1}^{n} (y_i - \hat{y}_i)^2, providing a direct assessment of how closely predictions align with reality on average. It serves as a cornerstone for and validation in fields such as , , and , where minimizing MSPE guides choices between simpler and more complex models. A related metric, the root mean squared prediction error (RMSPE), takes the of MSPE to express error in the original units of the target variable, aiding interpretability. The MSPE decomposes into three components—squared bias (systematic prediction error), variance of the predictor (sensitivity to training data fluctuations), and irreducible noise—illustrating the inherent trade-off between underfitting and in predictive modeling. For instance, in ordinary least squares regression, the optimal predictor under MSPE is the E[YX]\mathbb{E}[Y \mid X], which minimizes the risk function R(g)=E[(Yg(X))2]R(g) = \mathbb{E}[(Y - g(X))^2]. This decomposition underscores MSPE's role in balancing model flexibility with generalization, influencing techniques like cross-validation to reliably estimate it.

Basic Concepts

Definition

The mean squared prediction error (MSPE) serves as a key measure of predictive accuracy in statistical modeling, representing the of the squared difference between a model's predicted value and the actual outcome for a new or unseen observation. This metric quantifies how well a model generalizes beyond the data used to train it, capturing both and variance in predictions. In contrast to the (MSE), which evaluates the performance of an estimator by computing the expected squared deviation from the true underlying , MSPE specifically emphasizes the quality of in a prediction setting, where the focus is on future responses rather than fitted values from the training data. This distinction highlights MSPE's role in assessing out-of-sample performance, making it particularly valuable for and validation in regression and tasks. For instance, consider a model predicting prices based on variables such as square footage and neighborhood characteristics; here, MSPE measures the squared deviation between the model's price forecasts and actual transaction prices for new listings, offering a direct gauge of the forecasts' reliability on a squared scale.

Interpretation

The mean squared prediction error (MSPE) serves as a key metric for evaluating the inaccuracy in a model's predictions, representing the expected value of the squared differences between actual and predicted outcomes. In practical terms, it captures how closely a model's forecasts align with observed data on , with smaller MSPE values signaling superior predictive accuracy and reliability for future observations. Because MSPE involves squaring the errors, it is reported in units that are the square of the target variable's units, rendering it inherently scale-dependent and challenging to interpret directly in the context of the original data scale. For instance, if the target is measured in dollars, MSPE would be in dollars squared, which may obscure intuitive understanding without additional normalization. Assessing whether an MSPE value is "good" remains highly context-dependent, varying by field, data scale, and baseline expectations; there is no universal threshold, but in domains like financial forecasting, an MSPE substantially below the unconditional variance of the target variable is often deemed acceptable, with relative reductions of 10-20% compared to simple benchmarks (such as random walks) highlighting meaningful improvements. A notable limitation of MSPE is its heightened sensitivity to outliers, as the squaring process disproportionately penalizes large errors relative to smaller ones, potentially skewing assessments in noisy datasets. Furthermore, its squared-unit nature limits direct interpretability, prompting frequent use of the root mean squared prediction error (RMSPE), the of MSPE, as a variant that restores the original scale for more accessible analysis.

Mathematical Formulation

Population MSPE

The population mean squared prediction (MSPE) represents the theoretical average squared deviation between true outcomes and predictions across the entire , assuming access to infinite from a stationary distribution. This metric serves as an ideal benchmark for model performance, capturing the minimal achievable under perfect conditions. It is particularly useful for understanding the fundamental limits of prediction in statistical models. Formally, the population MSPE is given by MSPE=E[(YY^)2],\text{MSPE} = E[(Y - \hat{Y})^2], where YY denotes the true outcome variable, Y^\hat{Y} is the predicted value (typically Y^=f^(X)\hat{Y} = \hat{f}(X) for a predictor function f^\hat{f} and covariates XX), and the expectation is over the population joint distribution of (Y,X)(Y, X). This formulation assumes a fixed true underlying model, where predictions are deterministic functions of the covariates, and the population distribution remains invariant over time or draws. These assumptions ensure that the MSPE reflects intrinsic model limitations rather than sampling variability. The MSPE can be intuitively decomposed as MSPE=Var(YX)+[Bias(f^(X))]2+Var(f^(X)),\text{MSPE} = \text{Var}(Y \mid X) + [\text{Bias}(\hat{f}(X))]^2 + \text{Var}(\hat{f}(X)), where Var(YX)\text{Var}(Y \mid X) is the irreducible error arising from stochastic noise in YY conditional on XX, Bias(f^(X))=E[f^(X)]E[YX]\text{Bias}(\hat{f}(X)) = E[\hat{f}(X)] - E[Y \mid X] quantifies the average deviation of the predictor from the true conditional expectation, and Var(f^(X))\text{Var}(\hat{f}(X)) measures the predictor's variability across possible realizations (which diminishes to zero in the infinite-data population limit for consistent estimators). This breakdown highlights how prediction error stems from inherent data noise, systematic model mismatch, and predictor instability, providing an intuitive entry point to error sources without exhaustive analysis. In the context of linear regression over a population, suppose the true model is Y=β0+βTX+ϵY = \beta_0 + \boldsymbol{\beta}^T X + \epsilon, with E[ϵX]=0E[\epsilon \mid X] = 0 and Var(ϵX)=σ2\text{Var}(\epsilon \mid X) = \sigma^2. Using the population least-squares coefficients (attainable with infinite data), the predictor f^(X)=β0+βTX\hat{f}(X) = \beta_0 + \boldsymbol{\beta}^T X incurs no bias or variance, yielding MSPE=σ2\text{MSPE} = \sigma^2, the irreducible error. If the linear form is misspecified relative to the true E[YX]E[Y \mid X], the MSPE includes an additional bias term, manifesting as estimation error from the model's inability to capture nonlinearity, though variance remains negligible in this idealized setting.

Sample MSPE

The sample mean squared prediction error (MSPE) adapts the theoretical population MSPE to finite datasets, providing an of prediction accuracy based on observed . Unlike the population version, which represents an over infinite , the sample MSPE is calculated directly from a limited number of observations, making it susceptible to variability and in small datasets. This empirical formulation serves as the theoretical target for evaluating model performance in practice. The standard formula for sample MSPE is MSPE=1ni=1n(yiy^i)2,\text{MSPE} = \frac{1}{n} \sum_{i=1}^{n} (y_i - \hat{y}_i)^2, where yiy_i denotes the observed values in the , y^i\hat{y}_i the corresponding from the model, and nn the number of observations used in the . Here, the y^i\hat{y}_i may be generated on the same used for model fitting (in-sample) or on a separate held-out portion (out-of-sample set). In sample contexts, a critical distinction arises between and sets: on the set often yield optimistically low MSPE values due to , whereas set evaluations better reflect generalization to unseen . In small samples, the unadjusted sample MSPE can underestimate the true prediction error by failing to account for model complexity. To mitigate this, adjustments incorporating are applied, such as dividing the sum of squared errors by npn - p (where pp is the number of estimated parameters) to obtain an unbiased estimate of the error variance, akin to the standard MSE in . This correction helps prevent downward bias, particularly when nn is close to pp. For illustration, consider computing sample MSPE in a forecasting model applied to a of 100 observations, such as data on economic indicators. The model might be fitted to the first 80 observations (training set) to generate predictions, with the remaining 20 held out as the test set. The sample MSPE is then the average of the squared differences between the 20 test observations and their one-step-ahead , yielding a scalar value that quantifies the model's predictive fidelity on this finite holdout sample.

Computation Methods

Out-of-Sample Computation

Out-of-sample mean squared prediction error (MSPE) is computed by first partitioning the dataset into a set, used for model fitting, and a separate test set reserved for evaluation. The model is trained solely on the data to generate parameter estimates, after which predictions are produced for each in the test set based on its features. The MSPE is then obtained by averaging the squared residuals between the observed test values and these predictions, providing a direct measure of predictive accuracy on unseen . This method delivers an unbiased assessment of the model's ability to generalize to new data, distinct from training performance, and is essential for identifying where a model performs well on familiar data but poorly on novel instances. For time-series data, out-of-sample computation requires careful handling to maintain temporal dependencies and prevent the use of information in training. A common strategy involves a hold-out period, where the final portion of the series (e.g., the last 20% of observations) serves as the test set, with the model fitted to all preceding data. Alternatively, rolling windows are employed, in which the training window slides forward: for each step, the model is refitted on a contiguous block of past observations to the next one or more periods, and prediction errors are aggregated across these steps to compute the overall MSPE. This respects the chronological order and simulates real-world scenarios. The following Python pseudocode illustrates a basic implementation using scikit-learn for out-of-sample MSPE in a non-time-series context; for time-series, the split would use sequential indexing instead of random partitioning:

python

from sklearn.model_selection import train_test_split from sklearn.linear_model import LinearRegression from sklearn.metrics import mean_squared_error # Assume X (features) and y (target) are defined X_train, X_test, y_train, y_test = train_test_split(X, y, test_size=0.2, random_state=42) model = LinearRegression() model.fit(X_train, y_train) y_pred = model.predict(X_test) mspe = mean_squared_error(y_test, y_pred) print(f"Out-of-sample MSPE: {mspe}")

from sklearn.model_selection import train_test_split from sklearn.linear_model import LinearRegression from sklearn.metrics import mean_squared_error # Assume X (features) and y (target) are defined X_train, X_test, y_train, y_test = train_test_split(X, y, test_size=0.2, random_state=42) model = LinearRegression() model.fit(X_train, y_train) y_pred = model.predict(X_test) mspe = mean_squared_error(y_test, y_pred) print(f"Out-of-sample MSPE: {mspe}")

This computes the sample MSPE as referenced earlier.

In-Sample Computation

The in-sample mean squared prediction error (MSPE) is obtained by fitting a predictive model to the dataset, generating predictions for those same training observations, and then averaging the squared residuals between the actual and predicted values. This procedure yields the training error, formally expressed as Errtr=1ni=1n(yif^(xi))2,\text{Err}_{\text{tr}} = \frac{1}{n} \sum_{i=1}^n (y_i - \hat{f}(x_i))^2, where nn denotes the number of training samples, yiy_i the observed responses, and f^(xi)\hat{f}(x_i) the model's predictions on the training inputs xix_i. In the context of ordinary least squares (OLS) regression, this in-sample MSPE simplifies to the residual sum of squares (RSS) divided by the sample size nn, providing a direct measure of the model's fit to the data used for estimation. Despite its simplicity, the in-sample MSPE systematically underestimates the true expected prediction error on unseen data due to , where the model captures noise in the training set rather than underlying patterns, leading to overly performance assessments. This downward , termed , arises from the positive between predictions and residuals in fitted models and increases with model complexity, such as the number of parameters. To quantify and correct for this , the Mallows' CpC_p offers a practical adjustment, estimating the MSPE as Cp=RSSpσ^2(n2p)C_p = \frac{\text{RSS}_p}{\hat{\sigma}^2} - (n - 2p), where RSSp\text{RSS}_p is the RSS for a model with pp parameters and σ^2\hat{\sigma}^2 is an unbiased estimate of the irreducible error variance, typically derived from the full model's residuals. Under a correctly specified model, E[Cp]pE[C_p] \approx p, allowing identification of overfit subsets where Cp>pC_p > p. In-sample MSPE computation serves as a convenient initial diagnostic for evaluating model adequacy on the training data prior to more reliable out-of-sample evaluation.

Estimation Techniques

Population Estimation

Estimating the population mean squared prediction error (MSPE), defined as the expected squared difference between actual and predicted values over the entire population, requires methods that approximate this quantity from finite sample data while accounting for model complexity and sampling variability. These estimators typically rely on parametric assumptions about the underlying model to derive unbiased or asymptotically consistent approximations of the true MSPE. Common approaches include analytical formulas for specific model classes and resampling techniques that simulate population behavior. In linear regression models, analytical estimators such as the adjusted R-squared provide a direct way to approximate the population MSPE. The adjusted R-squared, given by Rˉ2=1(1R2)n1np1\bar{R}^2 = 1 - (1 - R^2) \frac{n-1}{n-p-1}, where R2R^2 is the coefficient of determination, nn is the sample size, and pp is the number of predictors, estimates the expected out-of-sample R2R^2, which relates to the MSPE via MSPEVar^(Y)(1Rˉ2)\text{MSPE} \approx \widehat{\mathrm{Var}}(Y) (1 - \bar{R}^2)
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