One of the main utilities of the epigraph and the hypograph index is to be able to measure ``extremality’’ of a curve with respect to a bunch of curves and to provide and ordination of the curves from top to bottom or vice-versa.
EHyClus is a methodology for clustering functional data which is based in four steps:
In ehymet
, the function that allows us to perform this
process is EHyClus
.
EHyClus function is designed for clustering functional datasets. The input data can be a one-dimensional dataset, \(n \times p\) matrix, or a multidimensional one, \(n \times p \times q\) array. The function transforms the initial dataset by first smoothing the data and then applying different indices analyzed on the first vignette such as the epigraph, hypograph, and their modified versions, and then applies various clustering algorithms to this dataset. Indices for one or multiple dimension are applied depending on the size of the input data.
It supports multiple clustering methods: hierarchical
clustering (“hierarch”), k-means (“kmeans”),
kernel k-means (“kkmeans”), and spectral
clustering (“spc”). Also, it allows customization of
hierarchical clustering methods, distance metrics, and kernels using
parameters like l_dist_hierarch
.
For smoothing, it uses B-splines with a specified or automatically selected number of basis functions.
To check the quality of the results, if true labels are provided, the function can validate the clustering results and compute performance metrics such as purity, F-measure, and Rand Index (RI). Also, it records the time taken for each clustering method, in case you want to measure it in case of wanting to know the trade-off between results and execution time
All the parameters and its functionality can be found on the function documentation, but arguably the most important ones are:
In this subsection, we are going to display how to obtain the results
of the EHyClus
function and validate them (if
true_labels
are present). First, we are going to generate
multidimensional data using sim_model_ex2
:
And, as we are generating \(n = 50\) curves per group and there are two groups, the true labels are:
We can run the algorithm with or without the true labels. For the combinations of variables, we will use “d2dtaMEI” with “d2dtaMHI”.
res <- EHyClus(curves, vars_combinations = list(c("d2dtaMEI", "d2dtaMHI")))
res_with_labels <- EHyClus(curves,
vars_combinations = list(c("d2dtaMEI", "d2dtaMHI")),
true_labels = true_labels
)
For the result without labels, it can be seen that we only have the generated clusters:
Whereas the one we generated with labels has both
cluster
and metrics
:
Let’s explore both components of the latter. We’re going to start
with cluster
.
#> levelName
#> 1 cluster
#> 2 ¦--hierarch
#> 3 ¦ ¦--hierarch_single_euclidean_d2dtaMEId2dtaMHI
#> 4 ¦ ¦--hierarch_complete_euclidean_d2dtaMEId2dtaMHI
#> 5 ¦ ¦--hierarch_average_euclidean_d2dtaMEId2dtaMHI
#> 6 ¦ ¦--hierarch_centroid_euclidean_d2dtaMEId2dtaMHI
#> 7 ¦ ¦--hierarch_ward.D2_euclidean_d2dtaMEId2dtaMHI
#> 8 ¦ ¦--hierarch_single_manhattan_d2dtaMEId2dtaMHI
#> 9 ¦ ¦--hierarch_complete_manhattan_d2dtaMEId2dtaMHI
#> 10 ¦ ¦--hierarch_average_manhattan_d2dtaMEId2dtaMHI
#> 11 ¦ ¦--hierarch_centroid_manhattan_d2dtaMEId2dtaMHI
#> 12 ¦ °--hierarch_ward.D2_manhattan_d2dtaMEId2dtaMHI
#> 13 ¦--kmeans
#> 14 ¦ ¦--kmeans_euclidean_d2dtaMEId2dtaMHI
#> 15 ¦ °--kmeans_mahalanobis_d2dtaMEId2dtaMHI
#> 16 ¦--kkmeans
#> 17 ¦ ¦--kkmeans_rbfdot_d2dtaMEId2dtaMHI
#> 18 ¦ °--kkmeans_polydot_d2dtaMEId2dtaMHI
#> 19 °--spc
#> 20 ¦--spc_rbfdot_d2dtaMEId2dtaMHI
#> 21 °--spc_polydot_d2dtaMEId2dtaMHI
In the suffix of the names we can see the combination of variables used, that is “d2dtaMEI” with “d2dtaMHI”. We can also see the different parameters used. For example, for the kmeans it is easy to see that it has been performed with both the Euclidean and the Mahalanobis distances.
Looking in particular at some of the elements, we see that it contains the following:
str(res_with_labels$cluster$hierarch$hierarch_ward.D2_euclidean_d2dtaMEId2dtaMHI)
#> List of 3
#> $ cluster: int [1:100] 1 1 1 1 1 1 1 1 1 1 ...
#> $ valid : 'table' num [1:3(1d)] 0.93 0.868 0.869
#> ..- attr(*, "dimnames")=List of 1
#> .. ..$ : chr [1:3] "Purity" "Fmeasure" "RI"
#> $ time : num 0.000973
On the one hand we have cluster
which is the vector that
assigns each of the curves to a cluster. Then we have
valid
, which is the validation data. And finally
time
, which is the time that this particular method has
taken to be executed. Let’s take a look at valid
:
head(res_with_labels$cluster$hierarch$hierarch_ward.D2_euclidean_d2dtaMEId2dtaMHI$valid)
#> Purity Fmeasure RI
#> 0.9300 0.8678 0.8685
It gives us 3 metrics: Purity, F-measure and the Rand Index (RI).
However, we can obtain this information in another way. Going back to
the second element of res_with_labels
: metrics
give us a summary of all metrics:
head(res_with_labels$metrics, 3)
#> Purity Fmeasure RI Time
#> kmeans_euclidean_d2dtaMEId2dtaMHI 1.00 1.0000 1.0000 0.0084872246
#> kmeans_mahalanobis_d2dtaMEId2dtaMHI 1.00 1.0000 1.0000 0.0089440346
#> hierarch_ward.D2_euclidean_d2dtaMEId2dtaMHI 0.93 0.8678 0.8685 0.0009729862
It gives us the Purity, F-measure, RI and Time for every clustering method with every combination of parameters that has been executed. We can search for “hierarch_single_euclidean_d2dtaMEId2dtaMHI” and see that it yields the same results as seen previously:
res_with_labels$metrics["hierarch_single_euclidean_d2dtaMEId2dtaMHI", ]
#> Purity Fmeasure RI Time
#> hierarch_single_euclidean_d2dtaMEId2dtaMHI 0.52 0.6535 0.4958 0.001051903
But now imagine that we executed EHyClus
without giving
the true_labels
parameter but we want to compute the
metrics. For that purpose, we can use the
clustering_validation
function, using the true labels as
the first parameter and the ones generated by the clustering method as
the second one:
clustering_validation(true_labels, res$cluster$hierarch$hierarch_single_euclidean_d2dtaMEId2dtaMHI$cluster)
#> Purity Fmeasure RI
#> 0.5200 0.6535 0.4958
Note that we are only taking a look at some of the result. Let’s see if some of them have given us better metrics. Results are sorted based on the RI:
head(res_with_labels$metrics, 5)
#> Purity Fmeasure RI Time
#> kmeans_euclidean_d2dtaMEId2dtaMHI 1.00 1.0000 1.0000 0.0084872246
#> kmeans_mahalanobis_d2dtaMEId2dtaMHI 1.00 1.0000 1.0000 0.0089440346
#> hierarch_ward.D2_euclidean_d2dtaMEId2dtaMHI 0.93 0.8678 0.8685 0.0009729862
#> hierarch_ward.D2_manhattan_d2dtaMEId2dtaMHI 0.93 0.8685 0.8685 0.0010530949
#> kkmeans_rbfdot_d2dtaMEId2dtaMHI 0.77 0.6684 0.6422 0.1124079227
Indeed, we can see that some methods have given us excellent results, performing an almost perfect clustering.
In addition, if we only want to obtain the results for the best
clustering method, we can use the only_best
parameter. Note
that this parameter only works when true_labels
is
provided.
res_only_best <- EHyClus(curves,
vars_combinations = list(c("d2dtaMEI", "d2dtaMHI")),
true_labels = true_labels,
only_best = TRUE
)
If we inspect the object, we see that in fact it only contains the results of the clustering method that has obtained the best results.
res_only_best$cluster
#> $kmeans_euclidean_d2dtaMEId2dtaMHI
#> $kmeans_euclidean_d2dtaMEId2dtaMHI$cluster
#> [1] 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 1 1 1 1 1 1 1 1 1
#> [61] 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
#>
#> $kmeans_euclidean_d2dtaMEId2dtaMHI$valid
#> Purity Fmeasure RI
#> 1 1 1
#>
#> $kmeans_euclidean_d2dtaMEId2dtaMHI$time
#> [1] 0.011976
res_only_best$metrics
#> Purity Fmeasure RI Time
#> kmeans_euclidean_d2dtaMEId2dtaMHI 1 1 1 0.011976
This can be useful if you want to use the function as if it were a typical clustering method.