2023-09-29
Authors:
The gofedf
package provides computational tools to apply
goodness-of-fit tests based on empirical distribution function theory.
The package offers functions and routines to test the hypothesis that a
univariate sample follows a distribution based on the empirical
distribution function. The theory is founded on reducing the problem to
a stochastic process and computing its covariance function. An
approximate p-value is computed using the Imhof
or Farebrother
method based on the limiting distribution of the statistic (see note
section for more details about choice of method). Users can run the test
by calculating either the Cramer-von Mises or Anderson-Darling
statistic. The covariance function of the stochastic process relies on
specific characteristics of the assumed model. Notably, knowledge of the
Fisher information matrix and the partial derivatives of the cumulative
distribution function is crucial for computing the covariance function.
However, obtaining these quantities can be computationally intensive or
challenging in general likelihood models. To overcome this limitation,
we propose an alternative method for estimating the covariance function
of the stochastic process directly from the sample data. The package
provides tools for this estimation and for testing if a sample comes
from any general likelihood model. In summary, the package can be used
to apply a goodness-of-fit test in any of the following settings:
Validate if the assumptions about the response variable in a generalized linear model (with any link function) are satisfied. The current version only checks for the Gamma distribution.
Validate if the normality assumptions in a linear model are satisfied.
Apply a goodness-of-fit test to examine if a set of bivariate samples follows a Normal, Gamma, or Exponential distribution.
Formal model evaluation in a general likelihood model. In this case, probability inverse transformed (PIT) values of the sample and the score function (if any parameter estimation is involved) are required. See the example for more details.
You can install the released version of gofedf
from
CRAN with:
install.packages('gofedf')
or the development version from GitHub page with:
# install.packages("devtools")
devtools::install_github('pnickchi/gofedf')
In this section, we will review the package’s primary functions and provide illustrative examples to demonstrate their usage. The first two examples relate to applying the goodness-of-fit (GOF) test for i.i.d. samples, while the last two focus on linear models and generalized linear models. The final example showcases the most important feature of the package, allowing you to apply goodness-of-fit tests based on empirical distribution function EDF for a general likelihood model.
The first example illustrates the GOF test for an i.i.d. sample from a
Normal distribution. The main function is testNormal
. At the minimum,
it requires a numeric vector as input. By default, it uses probability
inverse-transformed values to compute the stochastic process and its
covariance function later. You can change this behavior by setting
gridpit = FALSE
and assigning a positive value for ngrid
. The
default value for ngrid
is the same as the number of observations,
n
. This means the (0,1) interval is divided into n
equally spaced
data points to compute the stochastic process and the covariance
function. Additionally, the Fisher information matrix, by default, is
estimated by the variance of the score function. To change this, you can
set hessian=TRUE
to estimate the Fisher information matrix using the
Hessian instead. Finally, method is a string that defines the statistic
to compute. Possible values are cvm
for Cramer-von-Mises, ad
for
Anderson-Darling, and both to compute both.
# Reproducible example
set.seed(123)
# Randomly generate some data from Normal distribution
n <- 50
x <- rnorm(n)
# Test if the data follows a Normal distribution by calculating the Cramer-von Mises statistic and approximate p-value of the test.
testNormal(x = x, method = 'cvm')
## $Statistic
## [1] 0.03781322
##
## $pvalue
## [1] 0.6766974
# Test if the data follows a Normal distribution by calculating the Anderson-Darling statistic and approximate p-value of the test.
testNormal(x = x, method = 'ad')
## $Statistic
## [1] 0.2179704
##
## $pvalue
## [1] 0.9426823
# Generate some random sample from a non Normal distribution.
x <- rgamma(n, shape = 3)
testNormal(x = x, method = 'cvm')
## $Statistic
## [1] 0.2141872
##
## $pvalue
## [1] 0.004302717
The second example illustrates the GOF test for an i.i.d. sample from a
Gamma distribution. The main function is testGamma
and the arguments
remain the same as Normal case.
# Reproducible example
set.seed(123)
# Randomly generate some data
n <- 50
x <- rgamma(n, shape = 3)
# Test if the data follows a Gamma distribution, calculate Cramer-von Mises statistic and approximate p-value
testGamma(x = x, method = 'cvm')
## $Statistic
## [1] 0.0549759
##
## $pvalue
## [1] 0.3553938
# Generate some random sample from a distribution that is not Gamma
x <- runif(n)
testNormal(x = x, method = 'cvm')
## $Statistic
## [1] 0.07085577
##
## $pvalue
## [1] 0.1730288
In this example, we illustrate how to apply GOF test to verify the
assumptions of a linear model. The main function is testLMNormal
. At
the minimum, a numeric vector of response variable, y
, and a vector/
matrix of explanatory variables, x
, are required. Conveniently, the
function can take an object of class “lm” and directly applies the
goodness-of-fit test. In this case, there is no need to pass x
and
y
. Note that if you decide to use this feature, you need to explicitly
ask lm
function to return the design matrix and response variable by
passing x=TRUE
and y=TRUE
(as shown in the example below). The other
arguments of the function are the same as previous examples.
# Reproducible example
set.seed(123)
# Create a set of explanatory variables and a response variable according to a linear model
# Sample size
n <- 50
# Number of explanatory variables
p <- 5
# Generate some coefficients
b <- runif(p)
# Simulate random explanatory variables
X <- matrix( runif(n*p), nrow = n, ncol = p)
# Generate some error terms from Normal distribution
e <- rnorm(n)
# Generate response variable according to the linear model
y <- X %*% b + e
# Test if the residuals of the model follows a Normal distribution, calculate Cramer-von Mises statistic and approximate p-value
testLMNormal(x = X, y)
## $Statistic
## [1] 0.02285164
##
## $pvalue
## [1] 0.9089065
# Or alternatively just pass 'lm.fit' object directly instead:
lm.fit <- lm(y ~ X, x = TRUE, y = TRUE)
testLMNormal(fit = lm.fit)
## $Statistic
## [1] 0.02285164
##
## $pvalue
## [1] 0.9089065
In this example, we illustrate how to apply the GOF test to verify if
the response variable in a generalized linear model with any link
function follows a Gamma distribution. The main function for this is
testGLMGamma
. At the minimum, you need a numeric vector of the
response variable, y
, a vector/matrix of explanatory variables, x
,
and a link function for the Gamma family. Conveniently, the function can
take an object of class glm
and directly apply the goodness-of-fit
test. You can use glm
or glm2
function from glm2
pacakge. We
recommend using the glm2
function from the glm2
package as it
provides better estimates for the coefficients and avoids convergence
issues in the optimization process. In either of these cases, there is
no need to pass x
and y
. However, if you decide to use this feature,
you must explicitly ask the glm
or glm2
function to return the
design matrix and response variable by passing x=TRUE
and y=TRUE
(as
shown in the example below). Additionally, you can pass a starting
value, start.value
, to be used as the initial value for MLE estimation
of the coefficients. The function also offers a list of parameters to
control the fitting process in glm
or glm2
functions. The other
arguments of the function remain consistent with previous examples.
# Reproducible example
set.seed(123)
# Create a set of explanatory variables and a response variable according to a generalized linear model.
# Sample size
n <- 50
# Number of explanatory variables
p <- 5
# Simulate random explanatory variables
X <- matrix( rnorm(n*p, mean = 10, sd = 0.1), nrow = n, ncol = p)
# Generate some coefficients
b <- runif(p)
# Generate some error terms from Gamma distribution
e <- rgamma(n, shape = 3)
# Generate response variable according to the generalized linear model (log link function)
y <- exp(X %*% b) * e
# Test if the Gamma assumptions of the response variable holds by calculating the Cramer-von Mises statistic and approximate p-value
testGLMGamma(x=X, y, l = 'log', method = 'cvm')
## $Statistic
## [1] 0.0870493
##
## $pvalue
## [1] 0.1896532
##
## $converged
## [1] TRUE
# Or alternatively just pass 'glm.fit' object directly instead:
glm.fit <- glm2::glm2(y ~ X, family = Gamma(link = 'log'), x = TRUE, y = TRUE)
testGLMGamma(fit = glm.fit, l = 'log')
## $Statistic
## [1] 0.0870493
##
## $pvalue
## [1] 0.1896532
##
## $converged
## [1] TRUE
One of the most important features of the package is to provide computational tools to apply the goodness-of-fit test based on empirical distribution functions for any general likelihood model. We provided tools to apply the test for Normal, Gamma, verify the assumptions in a linear model and generalized linear model. But this additional feature allows you to test if the sample come from any general likelihood model. For example, consider you have a sample of size $n$, such as $X_1, X_2, \ldots, X_n$, from a model with CDF of $F(X;\theta)$ where $\theta$ contains $p$ parameters. Before running the test, at the minimum you need the followings:
1) A numeric vector of observations, x
.
2) The probability inverse transformed or PIT values of the sample
which ought to be a numeric vector with the same size as x
and
with elements $F^{-1}(X_{i};\theta)$.
If $\theta$ is unknown, you also need to provide score function. This
needs to be a matrix with $n$ rows and $p$ columns where each row
measures the score of each observation. Note that the values are
computed as
$S(X_{i};\theta) = \frac{\partial}{\partial \theta} \log(f(X_{i};\theta))$
where $f(X_{i};\theta)$ is the probability density function. For sure,
if $\theta$ is not known, this means you need to compute the MLE of
$\theta$ to obtain item 1 and if needed the score function. The main
function to apply the GOF test in this case is testYourModel
. The
precision
argument sets the precision needed to check if the col sums
of score matrix are close enough to zero (log-likelihood is zero at
MLE). The other arguments of the function remain consistent with
previous examples.
In the following example, we demonstrate how to apply the
goodness-of-fit test to check if a sample follows an Inverse Gaussian
distribution, where the shape parameter depends on some weights. First,
we generate data from an Inverse Gaussian distribution. For illustrative
purposes, we include functions to compute the Maximum Likelihood
Estimation (MLE) and score function for the sample. In the following
chunck of code, inversegaussianScore
is a function that returns the
score for each observation, and inversegaussianPIT
is a function that
provides a vector of Probability Inverse Transformed (PIT) values.
Additionally, inversegaussianMLE
calculates the MLE of the mean and
shape parameter. Second we calculate score, PIT and MLE of parameters.
Finally we call testYourModel
function to apply the test.
# Example: Inverse Gaussian (IG) distribution with weights
# Reproducible example
set.seed(123)
# Set the sample size
n <- 50
# Assign weights
weights <- runif(n, min = 5, max = 6)
weights <- weights / sum(weights)
# Set mean and shape parameters for IG distribution.
mio <- 2
lambda <- 2
# Generate a random sample from IG distribution with weighted shape.
y <- statmod::rinvgauss(n, mean = mio, shape = lambda * weights)
# Compute MLE of parameters, score matrix, and pit values.
theta_hat <- inversegaussianMLE(obs = y, w = weights)
score.matrix <- inversegaussianScore(obs = y, w = weights, mle = theta_hat)
pit.values <- inversegaussianPIT(obs = y , w = weights, mle = theta_hat)
# Apply the goodness-of-fit test.
testYourModel(x = y, pit = pit.values, score = score.matrix)
## $Statistic
## Cramer-von-Mises Statistic
## 0.03292151
##
## $pvalue
## [1] 0.8436222
The calculation of the p-value for the goodness-of-fit test based on the
empirical distribution function relies on computing the tail probability
of a sum of chi-squared random variables. Specifically, after finding
the eigenvalues $\lambda_{1}, \lambda_{2}, \ldots, \lambda_{n}$, we need
to compute the p-value as follows:
$p-value = Pr\left(\sum_{i=1}^{n} \lambda_{i}Z_{i}^{2} \geq x\right)$,
where $Z_{i}^{2}$ is a random variable following $\chi^{2}{(1)}$
distribution and $x$ represents the statistic (cvm or ad). The
CompQuadForm
package is being used for this purpose as it contains
different methods for computing this tail probability. We were
particularly interested in the Farebrother
and Imhof
methods.
However, both the Imhof
and Farebrother
functions from the package
encounter difficulties when computing the p-value if the statistic is in
the very tail of the distribution or if some of the $\lambda{i}$ values
are very small. They may produce negative p-values or p-values that are
not accurate.
Through numerical experimentation in the GLM-Gamma case and comparison
between p-values generated by Imhof
and Farebrother
, we discovered a
way to solve this problem. After computing the eigenvalues, we remove
values that are extremely small (e.g., $1 \times 10^{-15}$). Then, we
divide the remaining eigenvalues into two sets: one set contains values
greater than $\frac{\lambda_{1}}{2000}$, and the other set contains
values less than $\frac{\lambda_{1}}{2000}$. We then compute the sum of
the eigenvalues in the second set and use this sum to compensate for the
deleted eigenvalues, thereby correcting the cvm or ad statistic. The
values of set one is used for p-value computation.
During the computation of the p-value, we theoretically obtain both a
lower bound (LB) and an upper bound (UB) for the p-value. If the LB is
greater than 1e-7, we compute the p-value using the Imhof
method and
ensure that the computed p-value falls within the range between LB and
UB. If it doesn’t, we calculate the p-value using the Farebrother
method. If the LB falls between 1e-10 and 1e-7, we compute the p-value
using the Farebrother
method. Finally, if the LB is less than 1e-10,
we first attempt to calculate the p-value using the Farebrother
method. If this attempt fails, we return both the LB and UB along with a
warning that CompQuadForm
failed to generate a valid p-value.
[1] Imhof, J.P. (1961). [Computing the Distribution of Quadratic Forms in Normal Variables] Biometrika, Vol. 48, 419-426.
[2] Farebrother R.W. (1984). [Algorithm AS 204: The distribution of a Positive Linear Combination of chi-squared random variables] Journal of the Royal Statistical Society, Vol. 33, No. 3, 332-339.
[3] Giner G. and Smyth G. K. (2016). [statmod: Probability calculations for the inverse Gaussian distribution] R Journal, Vol. 8, No 3, 339-351.
[4] Stephens, M.A. (1974). [EDF Statistics for Goodness of Fit and Some Comparisons.] Journal of the American Statistical Association, Vol. 69, 730-737.
[5] Stephens, M.A. (1976). [Asymptotic results for goodness-of-fit statistics with unknown parameters.] Annals of Statistics, Vol. 4, 357-369.
[6] Duchesne, P. and Lafaye De Micheaux, P. (2010). [Computing the distribution of quadratic forms: Further comparisons between the Liu-Tang-Zhang approximation and exact methods] Computational Statistics and Data Analysis, Vol. 54, 858-862.
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