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Clustering Algorithms - K-Means and Hierarchical Clustering

Clustering is a popular technique in Machine Learning that involves grouping similar data points together based on their characteristics. It is commonly used for data exploration, pattern recognition, and customer segmentation. In this lesson, we will dive into two widely used clustering algorithms: K-Means and Hierarchical Clustering.

K-Means Clustering

K-Means is a popular and intuitive clustering algorithm that aims to partition a dataset into K distinct clusters. The algorithm works by iteratively assigning data points to the nearest cluster centroid and updating the centroids based on the mean of the assigned points. The process continues until convergence, where the cluster assignments no longer change significantly.


from sklearn.cluster import KMeans

# Load data
data = ...

# Create K-Means model
kmeans = KMeans(n_clusters=3)

# Fit the model to the data
kmeans.fit(data)

# Get cluster assignments
cluster_assignments = kmeans.labels_

# Get cluster centroids
centroids = kmeans.cluster_centers_

K-Means requires the number of clusters (K) to be specified in advance. It is sensitive to the initial choice of centroids, so running the algorithm multiple times with different initializations can yield different results. Evaluation measures such as the Silhouette Coefficient can be used to assess the quality of the clustering.

Hierarchical Clustering

Hierarchical Clustering is another popular clustering algorithm that creates a hierarchy of clusters. It does not require specifying the number of clusters in advance. The algorithm starts by considering each data point as a separate cluster and progressively merges the closest clusters until all data points belong to a single cluster.


from scipy.cluster.hierarchy import linkage, dendrogram

# Load data
data = ...

# Perform hierarchical clustering
linkage_matrix = linkage(data, method='ward')

# Plot dendrogram
dendrogram(linkage_matrix)

Hierarchical Clustering can be visualized using a dendrogram that shows the fusion of clusters at each step. Different linkage methods, such as Ward, complete, average, and single linkage, can be used to measure the distance between clusters. The appropriate method depends on the data and the desired outcome.

Comparing K-Means and Hierarchical Clustering

K-Means and Hierarchical Clustering have different characteristics and are suitable for different scenarios. Here are a few points of comparison:

1. Number of Clusters

K-Means requires specifying the number of clusters in advance, while Hierarchical Clustering does not. K-Means is suitable when the number of clusters is known or can be estimated, whereas Hierarchical Clustering is useful when the structure of the data is unclear or when exploring different partition possibilities.

2. Complexity

K-Means has a relatively low computational complexity, making it efficient for large datasets. Hierarchical Clustering, on the other hand, can be computationally expensive, especially for large datasets. However, Hierarchical Clustering allows for more flexibility in terms of exploring different clustering levels.

3. Interpretability

K-Means tends to produce more evenly sized and compact clusters, making them easier to interpret. Hierarchical Clustering, with its hierarchical structure, provides insights into the relationships between different clusters and can be useful for understanding the data hierarchy.

Understanding and applying clustering algorithms like K-Means and Hierarchical Clustering will equip you with powerful tools for analyzing and organizing your data. Experiment with different parameters and evaluation metrics to find the best clustering strategy for your specific case. Happy clustering!