Doctor of Philosophy

dissertationWith the tremendous growth of data produced in the recent years, it is impossible to identify patterns or test hypotheses without reducing data size. Data mining is an area of science that extracts useful information from the data by discovering patterns and structures present in the data. In this dissertation, we will largely focus on clustering which is often the first step in any exploratory data mining task, where items that are similar to each other are grouped together, making downstream data analysis robust. Different clustering techniques have different strengths, and the resulting groupings provide different perspectives on the data. Due to the unsupervised nature i.e., the lack of domain experts who can label the data, validation of results is very difficult. While there are measures that compute "goodness" scores for clustering solutions as a whole, there are few methods that validate the assignment of individual data items to their clusters. To address these challenges we focus on developing a framework that can generate, compare, combine, and evaluate different solutions to make more robust and significant statements about the data. In the first part of this dissertation, we present fast and efficient techniques to generate and combine different clustering solutions. We build on some recent ideas on efficient representations of clusters of partitions to develop a well founded metric that is spatially aware to compare clusterings. With the ability to compare clusterings, we describe a heuristic to combine different solutions to produce a single high quality clustering. We also introduce a Markov chain Monte Carlo approach to sample different clusterings from the entire landscape to provide the users with a variety of choices. In the second part of this dissertation, we build certificates for individual data items and study their influence on effective data reduction. We present a geometric approach by defining regions of influence for data items and clusters and use this to develop adaptive sampling techniques to speedup machine learning algorithms. This dissertation is therefore a systematic approach to study the landscape of clusterings in an attempt to provide a better understanding of the data

Clustering Algorithms: Their Application to Gene Expression Data

Gene expression data hide vital information required to understand the biological process that takes place in a particular organism in relation to its environment. Deciphering the hidden patterns in gene expression data proffers a prodigious preference to strengthen the understanding of functional genomics. The complexity of biological networks and the volume of genes present increase the challenges of comprehending and interpretation of the resulting mass of data, which consists of millions of measurements; these data also inhibit vagueness, imprecision, and noise. Therefore, the use of clustering techniques is a first step toward addressing these challenges, which is essential in the data mining process to reveal natural structures and iden-tify interesting patterns in the underlying data. The clustering of gene expression data has been proven to be useful in making known the natural structure inherent in gene expression data, understanding gene functions, cellular processes, and subtypes of cells, mining useful information from noisy data, and understanding gene regulation. The other benefit of clustering gene expression data is the identification of homology, which is very important in vaccine design. This review examines the various clustering algorithms applicable to the gene expression data in order to discover and provide useful knowledge of the appropriate clustering technique that will guarantee stability and high degree of accuracy in its analysis procedure

Fuzzy-Granular Based Data Mining for Effective Decision Support in Biomedical Applications

Due to complexity of biomedical problems, adaptive and intelligent knowledge discovery and data mining systems are highly needed to help humans to understand the inherent mechanism of diseases. For biomedical classification problems, typically it is impossible to build a perfect classifier with 100% prediction accuracy. Hence a more realistic target is to build an effective Decision Support System (DSS). In this dissertation, a novel adaptive Fuzzy Association Rules (FARs) mining algorithm, named FARM-DS, is proposed to build such a DSS for binary classification problems in the biomedical domain. Empirical studies show that FARM-DS is competitive to state-of-the-art classifiers in terms of prediction accuracy. More importantly, FARs can provide strong decision support on disease diagnoses due to their easy interpretability. This dissertation also proposes a fuzzy-granular method to select informative and discriminative genes from huge microarray gene expression data. With fuzzy granulation, information loss in the process of gene selection is decreased. As a result, more informative genes for cancer classification are selected and more accurate classifiers can be modeled. Empirical studies show that the proposed method is more accurate than traditional algorithms for cancer classification. And hence we expect that genes being selected can be more helpful for further biological studies

Elastic differential evolution for automatic data clustering

In many practical applications, it is crucial to perform automatic data clustering without knowing the number of clusters in advance. The evolutionary computation paradigm is good at dealing with this task, but the existing algorithms encounter several deficiencies, such as the encoding redundancy and the cross-dimension learning error. In this article, we propose a novel elastic differential evolution algorithm to solve automatic data clustering. Unlike traditional methods, the proposed algorithm considers each clustering layout as a whole and adapts the cluster number and cluster centroids inherently through the variable-length encoding and the evolution operators. The encoding scheme contains no redundancy. To enable the individuals of different lengths to exchange information properly, we develop a subspace crossover and a two-phase mutation operator. The operators employ the basic method of differential evolution and, in addition, they consider the spatial information of cluster layouts to generate offspring solutions. Particularly, each dimension of the parameter vector interacts with its correlated dimensions, which not only adapts the cluster number but also avoids the cross-dimension learning error. The experimental results show that our algorithm outperforms the state-of-the-art algorithms that it is able to identify the correct number of clusters and obtain a good cluster validation value

Identifying projected clusters from gene expression profiles

In microarray gene expression data, clusters may hide in subspaces. Traditional clustering algorithms that make use of similarity measurements in the full input space may fail to detect the clusters. In recent years a number of algorithms have been proposed to identify this kind of projected clusters, but many of them rely on some critical parameters whose proper values are hard for users to determine. In this paper a new algorithm that dynamically adjusts its internal thresholds is proposed. It has a low dependency on user parameters while allowing users to input some domain knowledge should they be available. Experimental results show that the algorithm is capable of identifying some interesting projected clusters from real microarray data.published_or_final_versio

Improved K-means clustering algorithms : a thesis presented in partial fulfilment of the requirements for the degree of Doctor of Philosophy in Computer Science, Massey University, New Zealand

K-means clustering algorithm is designed to divide the samples into subsets with the goal that maximizes the intra-subset similarity and inter-subset dissimilarity where the similarity measures the relationship between two samples. As an unsupervised learning technique, K-means clustering algorithm is considered one of the most used clustering algorithms and has been applied in a variety of areas such as artificial intelligence, data mining, biology, psychology, marketing, medicine, etc. K-means clustering algorithm is not robust and its clustering result depends on the initialization, the similarity measure, and the predefined cluster number. Previous research focused on solving a part of these issues but has not focused on solving them in a unified framework. However, fixing one of these issues does not guarantee the best performance. To improve K-means clustering algorithm, one of the most famous and widely used clustering algorithms, by solving its issues simultaneously is challenging and significant. This thesis conducts an extensive research on K-means clustering algorithm aiming to improve it. First, we propose the Initialization-Similarity (IS) clustering algorithm to solve the issues of the initialization and the similarity measure of K-means clustering algorithm in a unified way. Specifically, we propose to fix the initialization of the clustering by using sum-of-norms (SON) which outputs the new representation of the original samples and to learn the similarity matrix based on the data distribution. Furthermore, the derived new representation is used to conduct K-means clustering. Second, we propose a Joint Feature Selection with Dynamic Spectral (FSDS) clustering algorithm to solve the issues of the cluster number determination, the similarity measure, and the robustness of the clustering by selecting effective features and reducing the influence of outliers simultaneously. Specifically, we propose to learn the similarity matrix based on the data distribution as well as adding the ranked constraint on the Laplacian matrix of the learned similarity matrix to automatically output the cluster number. Furthermore, the proposed algorithm employs the L2,1-norm as the sparse constraints on the regularization term and the loss function to remove the redundant features and reduce the influence of outliers respectively. Third, we propose a Joint Robust Multi-view (JRM) spectral clustering algorithm that conducts clustering for multi-view data while solving the initialization issue, the cluster number determination, the similarity measure learning, the removal of the redundant features, and the reduction of outlier influence in a unified way. Finally, the proposed algorithms outperformed the state-of-the-art clustering algorithms on real data sets. Moreover, we theoretically prove the convergences of the proposed optimization methods for the proposed objective functions