--- title: "Advanced features" output: rmarkdown::html_vignette vignette: > %\VignetteIndexEntry{Advanced features} %\VignetteEngine{knitr::rmarkdown} %\VignetteEncoding{UTF-8} --- ```{r setup, include = FALSE} knitr::opts_chunk$set(fig.align = "center") knitr::opts_chunk$set(fig.height = 6.5, fig.width = 7.5, dpi = 90, out.width = '100%') knitr::opts_chunk$set(comment = "#>") ``` ```{r include = FALSE} path_figures <- here::here(file.path("tools", "figures")) save_figures <- dir.exists(path_figures) ``` In this vignette we present additional features of the `sfclust` package. ## Packages We begin by loading the required packages. ```{r, warning = FALSE, message = FALSE} library(sfclust) library(stars) library(ggplot2) library(dplyr) ``` ## Data The simulated dataset used in this vignette, `stgaus`, is included in our package. It is a `stars` object with one variable, `y`, and two dimensions: `geometry` and `time`. The dataset represents continuous Gaussian measurements from 100 regions, observed daily over 91 days, starting in January 2024. ```{r} data("stgaus") stgaus ``` To gain some initial insights, we can aggregate the data weekly: ```{r, fig.height = 5} stweekly <- aggregate(stgaus, by = "week", FUN = mean) ggplot() + geom_stars(aes(fill = y), stweekly) + facet_wrap(~ time, ncol = 5) + scale_fill_distiller(palette = "RdBu") + theme_bw() ``` We can also examine the trends for each region: ```{r, fig.height = 6} stgaus |> st_set_dimensions("geometry", values = 1:nrow(stgaus)) |> as_tibble() |> ggplot() + geom_line(aes(time, y, group = geometry, color = factor(geometry)), linewidth = 0.3) + theme_bw() + theme(legend.position = "none") ``` Some regions exhibit similar trends over time, but the overall patterns are more complex than polynomial functions. Our goal is to cluster these regions while accounting for spatial contiguity. ## Clustering ### Model We assume that the response variable \( Y_{it} \) for region \( i \) at time \( t \) follows a normal distribution given the partition \( M \): $$ Y_{it} \mid \mu_{it}, M \stackrel{ind}{\sim} \text{Normal}(\mu_{it}, \sigma^2), $$ where the mean \( \mu_{it} \) is modeled based on the cluster assignment \( c_i \): $$ \mu_{it} = \alpha_{c_i} + f_{c_i,t}, $$ where \( \alpha_{c_i} \) is the intercept for cluster \( c_i \), and \( f_{c_i,t} \) is a latent random effect modeled as a random walk process. Specifically, we impose the condition: $$ f_{c_i,t} - f_{c_i,t-1} \sim N(0, \nu^{-1}), \quad \text{for } t = 2, \dots, n. $$ The prior for the hyperparameter \( \nu_c \) is defined as: $$ \log(\nu_c) \sim \text{Normal}(-2, 1). $$ ### INLA integration `sfclust` integrates seamlessly with `inla()`, letting us specify the within-cluster model above exactly as we would in a standard `INLA` workflow. The model formula (including random effects and priors) and any additional arguments are passed directly to `inla()`. The following formula defines a linear predictor with a first-order random walk and the prior `Normal(-2, 1)` on the log-precision described above; we reuse this `formula` object in the examples below. ```{r} formula <- y ~ f(id_time, model = "rw1", hyper = list(prec = list(prior = "normal", param = c(-2, 1)))) ``` You can define other latent models and priors following `INLA` conventions. Further documentation is available at [https://www.r-inla.org](https://www.r-inla.org). ### Penalizing the number of clusters The `logpen` argument sets the log-penalty on the number of clusters, specifically `log(1 - q)`, where `q` is the prior probability of keeping a cluster: there is no penalty when `logpen = 0`, and more negative values increasingly favor fewer clusters. A large negative value such as `-50` acts as a strong parsimony prior, meaning that any proposal to increase the number of clusters must improve the log marginal likelihood by around 50 units to have a high acceptance probability. ### Save options Besides `niter`, `burnin` discards the first iterations before saving samples, and `thin` retains only every `thin`-th iteration, reducing autocorrelation in the chain. Note that `niter` counts iterations *after* burn-in, so the algorithm runs `burnin + niter` iterations in total. To reduce the risk of losing intermediate results, especially given the computational cost of the algorithm, you can use the `path_save` argument to specify a file for saving the output, and `nsave` to define the frequency at which samples are saved. ### Sampling with `sfclust` We now put all of the above together. We start with 20 initial clusters (`nclust = 20`) and run the algorithm for only 50 iterations, using the strong penalty and formula defined above, and saving intermediate results to `"stgaus-mcmc-initial.rds"`. ```{r, eval = FALSE} set.seed(123) result0 <- sfclust(stgaus, nclust = 20, formula = formula, logpen = -50, niter = 50, burnin = 10, thin = 2, nmessage = 10, path_save = "stgaus-mcmc-initial.rds") result0 ``` ```{r, echo = FALSE} result0 <- readRDS(system.file("vigdata", "gaussian-mcmc1.rds", package = "sfclust")) result0 ``` The output indicates that after starting with 20 clusters, the algorithm created 11 new clusters (births), removed 8 clusters (deaths), changed the membership of 1 cluster, and modified the minimum spanning tree (MST) 2 times. The `plot` method allows us to select which graph to produce. For example, we can visualize only the log marginal likelihood to diagnose convergence. With just 50 iterations, we can see that the log marginal likelihood has not yet achieved convergence. ```{r, fig.dpi = 72, fig.height = 6} plot(result0, which = 3) ``` ### Continue sampling To achieve convergence, we can continue the sampling using the `update` function and specify the number of new iterations with the `niter` argument: ```{r, eval = FALSE} result <- update(result0, niter = 1000, nsave = 500, path_save = "stgaus-mcmc.rds") result ``` ```{r, echo = FALSE} result <- readRDS(system.file("vigdata", "gaussian-mcmc2.rds", package = "sfclust")) result ``` With 1000 additional iterations, there have been many clustering movements. Furthermore, when visualizing the results, we can observe that the log marginal likelihood has achieved convergence. ```{r, fig.dpi = 72, fig.height = 6} plot(result, which = 3) ``` The side-by-side comparison below highlights the contrast: panel (A) shows the unstable log marginal likelihood from the short initial run, while panel (B) shows the stabilized trajectory after the full run, indicating convergence. ```{r, fig.height = 3.5} gg1 <- plot(result0, which = 3) + labs(subtitle = "(A)") gg2 <- plot(result, which = 3) + labs(subtitle = "(B)") gg1 + gg2 if (save_figures) { ggsave(file.path(path_figures, "stgaus-marginal-likelihood.pdf"), width = 10, height = 4.5, device = cairo_pdf) } ``` The `update` function can also be used to select a different past iteration as the active clustering, without running additional MCMC. This is useful when you want to inspect or use a specific sample rather than the last one: ```{r} result_other <- update(result, sample = 750) result_other ``` ## Results The final iteration indicates that the algorithm identified 12 clusters, with a log marginal likelihood of 12,602.37. The largest cluster consists of 27 regions, while the smallest contains only one region. ```{r} summary(result, sort = TRUE) ``` Let's visualize the regions grouped by cluster. ```{r, fig.height = 4} plot(result, which = 1:2, sort = TRUE, legend = TRUE) ``` Let's visualize the original data grouped by cluster. ```{r, fig.height = 5} plot_clusters_series(result, y, sort = TRUE) + facet_wrap(~ cluster, ncol = 5) + labs(title = "Risk per cluster", y = "Response") ```