knitr::opts_chunk$set( collapse = TRUE, comment = "#>", fig.align = "center", fig.width = 7, fig.height = 6, cache = TRUE )
This vignette provides an overview of how to use the functions in the catalytic package that focuses on GLM Logistic Regression. The other catalytic vignettes go into other model-estimating functions.
The goal of the catalytic package is to build framework for catalytic prior distributions. Stabilizing high-dimensional working models by shrinking them towards simplified models. This is achieved by supplementing observed data with weighted synthetic data generated from a predictive distribution under the simpler model.
For more information, see [@catalytic_glm].
The two steps of using catalytic package for GLM Logistic Regression are
Initialization: The cat_glm_initialization
function constructs a cat_init
object based on the formula provided by the user to generate synthetic data. The resulting cat_init
object is tailored to facilitate further analysis, and is integral for subsequent modeling steps in the catalytic
package.
Choose Method(s): Users have the flexibility to choose from five main functions within the catalytic package: cat_glm
, cat_glm_tune
, cat_glm_bayes_joint_gibbs
, cat_glm_bayes
, and cat_glm_bayes_joint
. Each function serves a specific purpose in modeling with catalytic priors and offers distinct capabilities tailored to different modeling scenarios for GLM Logistic Regression. This approach enables users to seamlessly incorporate synthetic data with varying weights from different method into GLM Logistic Regression analyses, providing flexibility and control over the modeling process.
Creating a high-dimensional dataset with a low data size. This step involves increasing the number of features (dimensions) while keeping the number of observations (data size) relatively small. This is useful for testing the performance of catalytic
models in high-dimensional settings.
The swim
dataset is loaded and split into training (train_data
) and test (test_data
) datasets.
library(catalytic) set.seed(1) # Function for calculating the mean of logarithmic error between true response and estimated response get_mean_logarithmic_error <- function(Y, est_Y) { Y <- pmax(0.0001, pmin(0.9999, Y)) est_Y <- pmax(0.0001, pmin(0.9999, est_Y)) return(mean(Y * log(Y / est_Y) + (1 - Y) * log((1 - Y) / (1 - est_Y)))) } # Load swim dataset for binomial analysis data("swim") swim_data <- cbind(swim$x, swim$y) # Seperate observation data into train and test data n <- 5 * ncol(swim$x + 1) # Size for training data train_idx <- sample(1:nrow(swim_data), n) train_data <- swim_data[train_idx, ] test_data <- swim_data[-train_idx, ] dim(train_data)
In this section, we explore the foundational steps of fitting a logistic regression model (GLM) using the stats::glm
function with the binomial family.
# Fit a logistic regression model (GLM) glm_model <- stats::glm( formula = empyr1 ~ ., family = binomial, data = train_data ) predicted_y <- predict( glm_model, newdata = test_data, type = "response" ) cat( "MLE GLM Binomial Model - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = predicted_y ) )
Let us check the ROC curve of the predicted_y
from glm_model
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, predicted_y) plot(roc_curve, main = "ROC Curve (MLE)", col = "blue", lwd = 2)
catalytic
To initialize data for GLM Logistic Regression using the catalytic
package, the cat_glm_initialization
function is employed. This function facilitates the setup by preparing synthetic data tailored for modeling purposes.
Here's a breakdown of the parameters used:
formula
: Specifies the model formula, indicating the response variable (empyr1) modeled against a constant predictor. See ?stats::glm
for details on formula syntax.
family
: Defines the type of Generalized Linear Model (GLM) family, here set to binomial
for logistic regression.
data
: Represents the original dataset, structured as a data.frame
.
syn_size
: Determines the size of the synthetic data generated, defaulted to four times the number of columns in the original data.
x_degree
: Determines the degree of the polynomial terms for the predictors in the model, which affects the diversity or complexity of the predictor terms included in the model. Defaulted to NULL
, which means the degree for all predictors is 1.
resample_only
: Determines whether synthetic data is exclusively generated by resampling from the original dataset. By default, it is set to FALSE
, allowing the function to apply various resampling strategies based on the characteristics of dataset (e.g. flattening).
na_replace
: Specifies the method for handling missing values in the dataset, defaulted to stats::na.omit
. Here is mean
, which can replace NA
in data
with the mean of each column.
cat_init <- cat_glm_initialization( formula = empyr1 ~ 1, family = binomial, # Default: gaussian data = train_data, syn_size = 50, # Default: 4 times the number of predictors x_degree = NULL, # Default: NULL, which means degrees of all predictors are 1 resample_only = FALSE, # Default: FALSE na_replace = mean # Default: stats::na.omit ) cat_init
Here shows how users can simplify the input for cat_glm_initialization
. User do not have to specify syn_size
and other parameters, as they have default values, which mentioned above.
cat_init
object contains a list of attributes, which is typically generated from above function cat_glm_initialization
. These attributes provide comprehensive information for below modeling tasks or for user check.
Here's a breakdown of all attributes except the input parameters:
function_name
: The name of this function, which is cat_glm_initialization
.
obs_size
: The number of observations (rows) in the original dataset (obs_data
).
obs_data
: The original dataset (data
).
obs_x
: The covariates from original dataset (obs_data
).
obs_y
: The response from original dataset (obs_data
).
syn_size
: The size of synthetic data generated.
syn_data
: The synthetic data created for modeling purposes, based on the original dataset (obs_data
) characteristics.
syn_x
: The covariates from synthetic dataset (syn_data
).
syn_y
: The response from synthetic dataset (syn_data
).
syn_x_resample_inform
: The information detailing the process of resampling synthetic data.
size
: The total size of the combined dataset (obs_size
and syn_size
).
data
: The combined dataset (obs_data
and syn_data
).
x
: The combined covariates (obs_x
and syn_x
)
y
: The combined response (obs_y
and syn_y
)
For more details, please check ?cat_glm_initialization
.
names(cat_init)
And of course, user can extract items mentioned above from cat_glm_initialization
object.
# The number of observations (rows) in the original dataset (`obs_data`) cat_init$obs_size # The information detailing the process of resampling synthetic data cat_init$syn_x_resample_inform
The cat_glm
function fits a Generalized Linear Model (GLM) with a catalytic prior on the regression coefficients. It utilizes information from the cat_init
object generated during the initialization step, which includes both observed and synthetic data, plus other relevant information.
The GLM model is then fitted using the specified formula, family, and a single tau
(synthetic data down-weight factor). The resulting cat_glm
object encapsulates the fitted model, including estimated coefficients and family information, facilitating further analysis.
Here's a breakdown of the parameters used:
formula
: This parameter specifies the model formula used in the GLM (Generalized Linear Model). It defines the relationship between the response variable and the predictors. Alternatively, besides using in format RESPONSE ~ COVARIATES
, user can also use ~ COVARIATES
without specifying the response name, since the response name is defined in the initialization step.
cat_init
: This parameter is essential and represents the initialization object (cat_init
) created using [cat_glm_initialization
]{#Initialization}. It contains both observed and synthetic data, plus other relevant information, necessary for model fitting.
tau
: This parameter determines the down-weight assigned to synthetic data relative to observed data. It influences the influence of synthetic data in the model fitting process. If not specified (NULL
), it defaults to a one forth of the number of predictors.
cat_glm_model <- cat_glm( formula = empyr1 ~ female + agege35, # Same as `~ female + agege35` cat_init = cat_init, tau = 10 # Default: number of predictors / 4 ) cat_glm_model
Here shows how users can simplify the input for cat_glm
. User do not have to specify tau
, as tau
has default value , which mentioned above.
Let's check the prediction error.
cat_glm_predicted_y <- predict( cat_glm_model, newdata = test_data, type = "response" ) cat( "Catalytic `cat_glm` - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = cat_glm_predicted_y ) )
Let us check the ROC curve of the cat_glm_predicted_y
from cat_glm_model
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, cat_glm_predicted_y) plot(roc_curve, main = "ROC Curve (cat_glm)", col = "blue", lwd = 2)
Both cat_glm_model
and cat_glm_model
objects are outputs from the cat_glm
function, providing a list of attributes for further analysis or user inspection.
Here's a breakdown of all attributes except the input parameters:
function_name
: The name of the function (cat_glm
).
model
: The fitted GLM model object obtained from stats::glm
, with tau
.
coefficients
: The estimated coefficients from the fitted GLM model model
.
For more details, please check ?cat_glm
.
names(cat_glm_model)
User can extract items mentioned above from cat_glm
object.
# The formula used for modeling cat_glm_model$formula # The fitted GLM model object obtained from `stats::glm` with `tau` cat_glm_model$coefficients
The cat_glm_tune
function fits a GLM with a catalytic prior on the regression coefficients and provides options for optimizing model performance over a range of tau values(tau_seq
).
These methods empower users to fit and optimize GLM models with catalytic priors, leveraging both observed and synthetic data to enhance model performance and robustness in various statistical analyses.
This method computes the partial likelihood across a specified range of tau values (tau_seq
). It iterates through each tau value, evaluating its performance based on cross-validation folds (cv_fold_num
) to select the optimal tau that minimizes the discrepancy error.
Here's a breakdown of the parameters used:
formula
and cat_init
are same as above.
risk_estimate_method
: Method for risk estimation, chosen from "parametric_bootstrap", "cross_validation", "mallows_estimate", "steinian_estimate". In this example, "cross_validation" is used.
discrepancy_method
: Method for discrepancy calculation, chosen from "square_error", "classification_error", "logistic_deviance". In this example, "logistic_deviance" is used because the family is binomial
.
tau_seq
: Vector of positive numeric values for down-weighting synthetic data. Defaults to a sequence around one fourth of the number of predictors.
cross_validation_fold_num
: Number of folds for cross-validation. Defaults to 5.
cat_glm_tune_cv <- cat_glm_tune( formula = empyr1 ~ ., # Same as `~ .` cat_init = cat_init, risk_estimate_method = "cross_validation", # Default auto-select based on the data size discrepancy_method = "logistic_deviance", # Default auto-select based on family tau_seq = seq(0.1, 5.1, 0.5), # Default is a numeric sequence around the number of predictors / 4. Do not recommand to including 0 for cross validation. cross_validation_fold_num = 3 # Default: 5 ) cat_glm_tune_cv
User can plot the tau_seq (x) against discrepancy error (y) using the plot()
function. This plot will show the lowest discrepancy error at the optimal tau value.
plot(cat_glm_tune_cv)
This method estimates tau using bootstrap resampling, refining the model through iterative sampling to enhance robustness and accuracy.
Here's a breakdown of other parameters used:
tau_0
: Initial tau value used for discrepancy calculation in risk estimation. Defaults to one fourth of the number of predictors for binomial and 1 for gaussian.
bootstrap_iteration_times
: Number of bootstrap iterations for "parametric_bootstrap" risk estimation. Defaults to 100.
For the breakdown of other input parameters, please check section Cross Validation
cat_glm_tune_boots <- cat_glm_tune( formula = ~., # Same as `empyr1 ~ .` cat_init = cat_init, risk_estimate_method = "parametric_bootstrap", # Default auto-select based on the data size discrepancy_method = "logistic_deviance", # Default auto-select based on family tau_0 = 2, # Default: number of predictors / 4 parametric_bootstrap_iteration_times = 10, # Default: 100 ) cat_glm_tune_boots
This method computes the partial likelihood using a steinian estimate approach, optimizing the model based on observed and synthetic data.
For the breakdown of the input parameters, please check section Cross Validation and Bootstrap)
cat_glm_tune_stein <- cat_glm_tune( formula = ~., # Same as `empyr1 ~ .` cat_init = cat_init, risk_estimate_method = "steinian_estimate", # Default auto-select based on the data size discrepancy_method = "logistic_deviance", # default auto select based on family ) cat_glm_tune_stein
risk_estimate_method
and discrepancy_method
{#Recommendations}Choosing the appropriate risk_estimate_method and discrepancy_method depends on the data size, model complexity, and the specific requirements of user's analysis.
Choosing risk_estimate_method
Small to Medium Data Size (observation data size <= 200)
Large Data Size (observation data size > 200):
Setting discrepancy_method
GLM Family is binomial (family == "binomial")
GLM Family is not binomial (family != "binomial"):
catalytic_glm_gaussian
for more details.Of course, user don't need to worry about specifying these parameters explicitly, and they just need to simply provide the cat_init
object and the formula
. then cat_glm_tune
will automatically select risk_estimate_method
and discrepancy_method
based on the dataset size and GLM family type.
In this example, it is risk_estimate_method = "parametric_bootstrap"
and discrepancy_method = "logistic_deviance"
.
For the breakdown of the input parameters, please check section Cross Validation and Bootstrap
cat_glm_tune_auto <- cat_glm_tune( formula = ~., cat_init = cat_init ) cat_glm_tune_auto
Let's check the prediction error.
cat_glm_tune_predicted_y <- predict( cat_glm_tune_auto, newdata = test_data, type = "response" ) cat( "Catalytic `cat_glm_tune` - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = cat_glm_tune_predicted_y ) )
Let us check the ROC curve of the cat_glm_tune_predicted_y
from cat_glm_tune_auto
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, cat_glm_tune_predicted_y) plot(roc_curve, main = "ROC Curve (cat_glm_tune)", col = "blue", lwd = 2)
All above objects in this section including cat_glm_tune_auto
objects are outputs from the cat_glm_tune
function, providing a list of attributes for further analysis or user inspection.
Here's a breakdown of all attributes except the input parameters:
function_name
: The name of the function (cat_glm_tune
).
tau
: Selected optimal tau value from tau_seq
that minimizes discrepancy error.
model
: The fitted GLM model object obtained from stats::glm
, with the selected optimal tau (tau
).
coefficients
: The estimated coefficients from the fitted GLM model (model
).
risk_estimate_list
: Collected risk estimates across different tau values.
For more details, please check ?cat_glm_tune
.
names(cat_glm_tune_auto)
User can extract items mentioned above from cat_glm_tune
object.
# The method used for risk estimation cat_glm_tune_auto$risk_estimate_method # Selected optimal tau value from `tau_seq` that minimizes discrepancy error cat_glm_tune_auto$tau
Now, we will explore advanced Bayesian modeling techniques tailored for GLM Binomial using the catalytic
package. Bayesian inference offers a powerful framework to estimate model parameters and quantify uncertainty by integrating prior knowledge with observed data.
Below functions enable Bayesian inference for GLM Logistic Regression Model with catalytic priors. This function utilizes Markov chain Monte Carlo (MCMC) methods, implemented using the rstan
package, to sample from the posterior distribution of model parameters. Users can specify various options such as the number of MCMC chains (chains
), iterations (iter
), warmup steps (warmup
), and the MCMC algorithm (algorithm
). User could also apply other attributes to rstan::sampling
, like refresh
and control
.
In this section, we explore Bayesian approaches using the cat_glm_bayes
function from the catalytic
package. This function can fit a Bayesian Generalized Linear Model (GLM) using a fixed tau value. The MCMC sampling process will generate posterior distributions for the coefficients based on the specified tau.
Here's a breakdown of the parameters used:
formula
, cat_init
and tau
are same as above.
chains
: Number of Markov chains to run during MCMC sampling in rstan
. Defaults to 4.
iter
: Total number of iterations per chain in the MCMC sampling process in rstan
. Defaults to 2000.
warmup
: Number of warmup iterations in the MCMC sampling process in rstan
, discarded as burn-in. Defaults to 1000.
algorithm
: Specifies the sampling algorithm used in rstan
. Defaults to "NUTS" (No-U-Turn Sampler).
gaussian_variance_alpha
: The shape parameter for the inverse-gamma prior on variance if the variance is unknown in Gaussian models. Defaults to the number of predictors. More explanation in catalytic_glm_gaussian.Rmd
.
gaussian_variance_beta
: The scale parameter for the inverse-gamma prior on variance if the variance is unknown in Gaussian models. Defaults to the number of predictors times variance of observation response. More explanation in catalytic_glm_gaussian.Rmd
.
...
(ellipsis): Denotes additional arguments that can be passed directly to the underlying rstan::sampling
function used within cat_glm_bayes
to fit the Bayesian GLM model. These arguments allow for customization of the Bayesian GLM fitting process, such as control
, refresh
, or other model-specific settings.
For more details, please refer to ?cat_glm_bayes
.
cat_glm_bayes_model <- cat_glm_bayes( formula = empyr1 ~ ., # Same as `~ .` cat_init = cat_init, tau = 50, # Default: number of predictors / 4 chains = 1, # Default: 4 iter = 100, # Default: 2000 warmup = 50, # Default: 1000 algorithm = "NUTS" # Default: NUTS ) cat_glm_bayes_model
Here shows how users can simplify the input for cat_glm_bayes
. User do not have to specify tau
and other attributes, as tau
and other attributes have default value, which mentioned above. Here we assign lower value to chains
, iter
and warmup
for quicker processing time.
User can also get the trace plot of the rstan
model by using traceplot()
directly into the output from cat_glm_bayes
.
traceplot(cat_glm_bayes_model)
Plus, user can use this catlaytic::traceplot
just like the rstan::traceplot
, user can add parameters used in rstan::traceplot
, like include
and inc_warmup
.
traceplot(cat_glm_bayes_model, inc_warmup = TRUE)
Let's check the prediction error.
cat_glm_bayes_predicted_y <- predict( cat_glm_bayes_model, newdata = test_data, type = "response" ) cat( "MLE GLM Binomial Model - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = cat_glm_bayes_predicted_y ) )
Let us check the ROC curve of the cat_glm_bayes_predicted_y
from cat_glm_bayes_model
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, cat_glm_bayes_predicted_y) plot(roc_curve, main = "ROC Curve (cat_glm_bayes)", col = "blue", lwd = 2)
Both cat_glm_bayes_model
and cat_glm_bayes_model
objects are outputs from the cat_glm_bayes
function, providing a list of attributes for further analysis or user inspection.
Here's a breakdown of all attributes except the input parameters:
function_name
: The name of the function (cat_glm_bayes
).
stan_data
: The data list used for rstan::sampling
.
stan_model
: The rstan::stan_model
object used for Bayesian modeling.
stan_sample_model
: The result object obtained from rstan::sampling
, encapsulating the MCMC sampling results.
coefficients
: The mean estimated coefficients from the Bayesian GLM model, extracted from rstan::summary(stan_sample_model)$summary
.
For more details, please refer to ?cat_glm_bayes
.
names(cat_glm_bayes_model)
User can extract items mentioned above from cat_glm_bayes
object.
# The number of Markov chains used during MCMC sampling in `rstan`. cat_glm_bayes_model$chain # The mean estimated coefficients from the Bayesian GLM model cat_glm_bayes_model$coefficients
In this section, we delve into Bayesian methodologies employing the cat_glm_bayes_joint
function within the catalytic
package. Unlike its non-adaptive counterpart (cat_glm_bayes
), this method employs a joint tau prior approach where tau is treated as a parameter within the MCMC sampling process, improving the robustness and accuracy of parameter estimation in Bayesian Binomial modeling.
In this section, we explore Bayesian approaches using the cat_glm_bayes_joint
function from the catalytic
package. These functions are similar to their non-adaptive (non-joint) version (cat_glm_bayes
), but corporate tau
into the MCMC sampling process.
Here's a breakdown of the parameters used:
formula
, and cat_init
are same as above.
chains
, iter
, warmup
, algorithm
, gaussian_variance_alpha
and
gaussian_variance_beta
are same in section Bayesian Posterior Sampling with Fixed Tau.
tau_alpha
: Alpha parameter controlling degrees of freedom for distribution in the joint tau approach. Default is 2.
tau_gamma
: Gamma parameter in the joint tau approach. Default is 1.
binomial_joint_theta
: Logical. If TRUE, use theta parameter in the binomial model. Default is FALSE. More explanation in below section Incorporating theta (1/tau).
binomial_joint_alpha
: Logical. If TRUE, use joint alpha in the binomial model. Default is FALSE. More explanation in below section Incorporating theta (1/tau) with Adaptive Alpha.
binomial_tau_lower
: Lower limit for the tau parameter in the binomial model. Default is 0.05. More explanation in below section Setting Higher Tau Lower Bound.
...
(ellipsis): Denotes additional arguments that can be passed directly to the underlying rstan::sampling
function used within cat_glm_bayes
to fit the Bayesian GLM model. These arguments allow for customization of the Bayesian GLM fitting process, such as control
, refresh
, or other model-specific settings.
For more details, please refer to ?cat_glm_bayes_joint
.
cat_glm_bayes_joint_model <- cat_glm_bayes_joint( formula = empyr1 ~ ., # Same as `~ .` cat_init = cat_init, chains = 1, # Default: 4 iter = 100, # Default: 2000 warmup = 50, # Default: 1000 algorithm = "NUTS", # Default: NUTS tau_alpha = 2, # Default: 2 tau_gamma = 1 # Default: 1 ) cat_glm_bayes_joint_model
Here shows how users can simplify the input for cat_glm_bayes_joint
. User do not have to specify tau_alpha
and other attributes, as these attributes have default value, which mentioned above. Here we assign lower value to chains
, iter
and warmup
for quicker processing time.
User can also get the traceplot of the rstan
model by using traceplot()
directly into the output from cat_glm_bayes_joint
.
traceplot(cat_glm_bayes_joint_model)
Like the traceplot
shown in the cat_glm_bayes
function , user can add parameters used in rstan::traceplot
, like include
and inc_warmup
.
traceplot(cat_glm_bayes_joint_model, inc_warmup = TRUE)
Let's check the prediction error.
cat_glm_bayes_joint_predicted_y <- predict( cat_glm_bayes_joint_model, newdata = test_data, type = "response" ) cat( "Catlytic `cat_glm_bayes_joint` - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = cat_glm_bayes_joint_predicted_y ) )
Let us check the ROC curve of the cat_glm_bayes_joint_predicted_y
from cat_glm_bayes_joint_model
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, cat_glm_bayes_joint_predicted_y) plot(roc_curve, main = "ROC Curve (cat_glm_bayes_joint)", col = "blue", lwd = 2)
Both cat_glm_bayes_joint_model
and cat_glm_bayes_joint_model
objects are outputs from the cat_glm_bayes_joint
function, providing a list of attributes for further analysis or user inspection.
Here's a breakdown of all attributes except the input parameters:
function_name
: The name of the function (cat_glm_bayes_joint
).
tau
: The estimated tau parameter from the MCMC sampling rstan::sampling
, depending on the model configuration.
stan_data
, stan_model
, stan_sample_model
and coefficients
are same in section Bayesian Posterior Sampling with Fixed Tau.
For more details, please refer to ?cat_glm_bayes_joint
.
names(cat_glm_bayes_joint_model)
User can extract items mentioned above from cat_glm_bayes_joint
object.
# The estimated tau parameter from the MCMC sampling `rstan::sampling`, cat_glm_bayes_joint_model$tau # The mean estimated coefficients from the Bayesian GLM model cat_glm_bayes_joint_model$coefficients
Traditional methods like rstan
often face challenges in accurately fitting Binomial models, such as computational inefficiencies and convergence issues. To overcome these limitations, we would like to introduce below four specialized approaches designed to improve parameter estimation accuracy, enhance convergence rates, and better handle the complexities inherent in Binomial modeling.
Besides the above two approaches, cat_glm_bayes_joint_gibbs
function utilizes Gibbs sampling. enhancing performance in Bayesian modeling tasks.
This approach is particularly advantageous for handling complex data distributions and intricate variable inter-dependency. Gibbs sampling sequentially samples from conditional distributions, efficiently exploring joint posterior distributions and promoting faster convergence rates compared to direct rstan
approaches.
Within the cat_glm_bayes_joint_gibbs
function, Hamiltonian Monte Carlo (HMC) is employed for more efficient exploration of the parameter space, as described by Radford M. Neal (2010).
The Gibbs algorithm can be used to sample from the posterior distribution under the joint prior $\pi_{\alpha, \gamma}(\tau, \beta)$. The Gibbs algorithm iterative samples one component from the conditional distribution holding the other component fixed. Given coefficients ($\beta$), an update of τ can be sampled from the Gamma distribution.
$$ \pi_{\alpha, \gamma}(\tau | \beta, \mathbf{Y}, \mathbf{X}) \propto\Gamma_{\alpha, \gamma}(\tau) \exp \left( \frac{\tau}{M} \sum_{i=1}^{M} \log(f(Y_i^ | \beta^\top \mathbf{X}_i^)) \right) $$
$$ = \tau^{c-1} \exp \left( -\tau \left( \kappa + \frac{1}{\gamma} - \frac{1}{M} \sum_{i=1}^{M} \log(f(Y_i^ | \beta^\top \mathbf{X}_i^)) \right) \right) $$
Given tau ($\tau$), an update of coefficients ($\beta$) should be drawn from
$$ \pi(\beta | \tau, \mathbf{Y}, \mathbf{X}) \propto f(Y^|X^, \beta)^{\tau/M}f(Y|X, beta) $$
It can be sampled by various methods such as the Metropolis-Hasting algorithm and the Hamiltonian Monte Carlo (HMC). We recommend to use HMC with random step size and with adaptive variances for the momentum variables. Before running HMC within Gibbs, the adaptive variances are set at the diagonal entries of the inverse Hessian matrix of the negative log density at the posterior mode. The initial point of such a MCMC step should be the most recent sample of coefficients ($\beta$).
For more information, see [@catalytic_glm] and [@neal2012mcmc].
Here's a breakdown of the parameters used:
formula
, and cat_init
are same as above.
iter
: Total number of Gibbs sampling iterations. Defaults to 2000.
warmup
: Number of warmup iterations in Gibbs sampling. Defaults to 1000.
coefs_iter
: Number of iterations in the HMC sampling for coefficients. Defaults to 5.
tau_0
: Initial value for tau (down-weighting factor for synthetic data). Defaults to one forth of the number of predictors.
tau_alpha
: Shape parameter for the gamma distribution used in tau sampling. Defaults to 2.
tau_gamma
: Rate parameter for the gamma distribution used in tau sampling. Defaults to 1.
refresh
: Logical flag indicating whether to print progress in Gibbs sampling. Defaults to TRUE.
...
(ellipsis): Denotes additional arguments that can be passed directly to the underlying stats::glm
, for generating init_coefficients
if user not defined, such as control
, offset
, or other model-specific settings.
For more details, please refer to ?cat_glm_bayes_joint_gibbs
. Here we assign lower value to chains
, iter
and warmup
for quicker processing time.
cat_glm_bayes_joint_gibbs_model <- cat_glm_bayes_joint_gibbs( formula = empyr1 ~ ., # Same as `~ .` cat_init = cat_init, iter = 100, # Default: 1000 warmup = 50, # Default: 500 coefs_iter = 2, # Default: 5 tau_0 = 1, # Default: number of predictors / 4 tau_alpha = 2, # Default: 2 tau_gamma = 1, # Default: 1 refresh = TRUE # Default: TRUE ) cat_glm_bayes_joint_gibbs_model
Here shows how users can simplify the input for cat_glm_bayes_joint_gibbs
. User do not have to specify tau_0
and other attributes, as these attributes have default value, which mentioned above. Here we assign lower value to iter
and warmup
for quicker processing time.
User can also use traceplot()
to check the coefficients from cat_glm_bayes_joint_gibbs
.
traceplot(cat_glm_bayes_joint_gibbs_model)
And user can select the columns they would like to check.
traceplot(cat_glm_bayes_joint_gibbs_model, pars = c("female", "hsdip", "numchild"))
Let's check the prediction error.
cat_glm_bayes_joint_gibbs_predicted_y <- predict( cat_glm_bayes_joint_gibbs_model, newdata = test_data, type = "response" ) cat( "Catalytic `cat_glm_bayes_joint_gibbs` - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = cat_glm_bayes_joint_gibbs_predicted_y ) )
Let us check the ROC curve of the cat_glm_bayes_joint_gibbs_predicted_y
from cat_glm_bayes_joint_gibbs
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, cat_glm_bayes_joint_gibbs_predicted_y) plot(roc_curve, main = "ROC Curve (cat_glm_bayes_joint_gibbs)", col = "blue", lwd = 2)
Both cat_glm_bayes_joint_gibbs_model
and cat_glm_bayes_joint_gibbs_model
objects are outputs from the cat_glm_bayes_joint_gibbs
function, providing a list of attributes for further analysis or user inspection.
Here's a breakdown of all attributes except the input parameters:
function_name
: The name of the function (cat_glm_bayes_joint_gibbs
).
sys_time
: The date and time when sampling ended.
gibbs_iteration_log
: A matrix containing the Gibbs sampling results for both tau and coefficients.
inform_df
: The summary statistics including mean, standard error of mean, standard deviation, quantiles, and effective sample size for coefficients and tau.
tau
: The mean of estimated tau from sampled value.
coefficients
: The mean of estimated coefficients from sampled value.
For more details, please refer to ?cat_glm_bayes_joint_gibbs
.
names(cat_glm_bayes_joint_gibbs_model)
User can extract items mentioned above from cat_glm_bayes_joint_gibbs
object.
# The Date and time when sampling ended. cat_glm_bayes_joint_gibbs_model$sys_time # The summary statistics cat_glm_bayes_joint_gibbs_model$inform_df
Since the inefficiency in sampling is caused by small values of tau, a straightforward solution is to modify the joint prior by truncating tau to prevent it from approaching 0. The cat_glm_bayes_joint
function incorporates binomial_tau_lower
within the rstan
model to enhance its performance. Adjusting this lower bound transforms the parameter space, a critical step in leveraging Bayesian inference to manage complex data distributions effectively.
binomial_tau_lower
(default is 0.05) sets the minimum allowable value for the tau parameter in the Bayesian model, ensuring tau is greater than or equal to number_of_predictors * binomial_tau_lower
, which defines a suitable range for model calculations. This adjustment improves the coherence of the posterior density and enhances sampling outcomes. Additionally, the density of the second derivative is not too small, indicating improved performance.
For breakdown of input parameters and output attributes, please check section Bayesian Posterior Sampling with Adaptive Tau. Here we assign lower value to chains
, iter
and warmup
for quicker processing time.
cat_glm_bayes_joint_tau_lower <- cat_glm_bayes_joint( formula = ~., # Same as `empyr1 ~ .` cat_init = cat_init, binomial_tau_lower = 0.5, # Default: 0.05 chains = 1, # Default: 4 iter = 100, # Default: 2000 warmup = 50 # Default: 1000 ) cat_glm_bayes_joint_tau_lower
Let's check the prediction error.
cat_glm_bayes_joint_tau_lower_predicted_y <- predict( cat_glm_bayes_joint_tau_lower, newdata = test_data, type = "response" ) cat( "Catalytic `cat_glm_bayes_joint_tau_lower` - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = cat_glm_bayes_joint_tau_lower_predicted_y ) )
Let us check the ROC curve of the cat_glm_bayes_joint_tau_lower_predicted_y
from cat_glm_bayes_joint_tau_lower
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, cat_glm_bayes_joint_tau_lower_predicted_y) plot(roc_curve, main = "ROC Curve (MLE)", col = "blue", lwd = 2)
For GLM Binomial models, the joint distribution of tau and coefficients displays a banana-shape contour, which makes it challenging for the no-U-turn sampler to effectively transit over the parameter space. To address this, the cat_glm_bayes_joint
function introduces theta = 1/tau
into the rstan
model.
In the rstan
program used in this example, theta
serves as the inverse of tau, allowing the model to adjust its parameterization dynamically based on the the characteristics of data.
This approach enhances flexibility in model fitting, especially when dealing with datasets exhibiting diverse and complex patterns across different dimensions.
For breakdown of input parameters and output attributes, please check section Bayesian Posterior Sampling with Adaptive Tau. Here we assign lower value to chains
, iter
and warmup
for quicker processing time.
cat_glm_bayes_joint_theta <- cat_glm_bayes_joint( formula = ~., # Same as `empyr1 ~ .` cat_init = cat_init, binomial_joint_theta = TRUE, # Default: FALSE chains = 1, # Default: 4 iter = 100, # Default: 2000 warmup = 50 # Default: 1000 ) cat_glm_bayes_joint_theta
Let's check the prediction error.
cat_glm_bayes_joint_theta_predicted_y <- predict( cat_glm_bayes_joint_theta, newdata = test_data, type = "response" ) cat( "Catalytic `cat_glm_bayes_joint_theta` - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = cat_glm_bayes_joint_theta_predicted_y ) )
Let us check the ROC curve of the cat_glm_bayes_joint_theta_predicted_y
from cat_glm_bayes_joint_theta
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, cat_glm_bayes_joint_theta_predicted_y) plot(roc_curve, main = "ROC Curve (cat_glm_bayes_joint_theta)", col = "blue", lwd = 2)
Additionally, in scenarios where adjusting the spread of data (controlled by alpha
) significantly impacts model performance, the cat_glm_bayes_joint
function extends thetheta = 1/tau
approach by introducing a adaptive/joint alpha parameter. This enhancement in the rstan
model allows simultaneous adjustment of both theta and alpha parameters, aiming for better convergence and more accurate parameter estimates.
For breakdown of input parameters and output attributes, please check section Bayesian Posterior Sampling with Adaptive Tau. Here we assign lower value to chains
, iter
and warmup
for quicker processing time.
cat_glm_bayes_joint_alpha <- cat_glm_bayes_joint( formula = ~., # Same as `empyr1 ~ .` cat_init = cat_init, binomial_joint_theta = TRUE, # Default: FALSE binomial_joint_alpha = TRUE, # Default: FALSE chains = 1, # Default: 4 iter = 100, # Default: 2000 warmup = 50 # Default: 1000 ) cat_glm_bayes_joint_alpha
Let's check the prediction error.
cat_glm_bayes_joint_alpha_predicted_y <- predict( cat_glm_bayes_joint_alpha, newdata = test_data, type = "response" ) cat( "Catalytic `cat_glm_bayes_joint_alpha` - Logarithmic Error:", get_mean_logarithmic_error( Y = test_data$empyr1, est_Y = cat_glm_bayes_joint_alpha_predicted_y ) )
Let us check the ROC curve of the cat_glm_bayes_joint_alpha_predicted_y
from cat_glm_bayes_joint_alpha
versus the test_data$empyr1
, this can be a great way to visually assess the accuracy and performance of the model.
roc_curve <- pROC::roc(test_data$empyr1, cat_glm_bayes_joint_alpha_predicted_y) plot(roc_curve, main = "ROC Curve (cat_glm_bayes_joint_alpha)", col = "blue", lwd = 2)
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