Abstract

Many domains have a stake in the development of reliable systems for automatic protein classification. Of particular interest in recent studies of automatic protein classification is the exploration of new methods for extracting features from a protein that enhance classification for specific problems. These methods have proven very useful in one or two domains, but they have failed to generalize well across several domains (i.e. classification problems). In this paper, we evaluate several feature extraction approaches for representing proteins with the aim of sequence-based protein classification. Several protein representations are evaluated, those starting from: the position specific scoring matrix (PSSM) of the proteins; the amino-acid sequence; a matrix representation of the protein, of dimension (length of the protein) ×20, obtained using the substitution matrices for representing each amino-acid as a vector. A valuable result is that a texture descriptor can be extracted from the PSSM protein representation which improves the performance of standard descriptors based on the PSSM representation. Experimentally, we develop our systems by comparing several protein descriptors on nine different datasets. Each descriptor is used to train a support vector machine (SVM) or an ensemble of SVM. Although different stand-alone descriptors work well on some datasets (but not on others), we have discovered that fusion among classifiers trained using different descriptors obtains a good performance across all the tested datasets. Matlab code/Datasets used in the proposed paper are available at http://www.bias.csr.unibo.it\nanni\PSSM.rar.

Highlights

  • The explosion of protein sequences generated in the postgenomic era has not been followed by an equal increase in the knowledge of protein biological attributes, which are essential for basic research and drug development

  • Notice that the representation method DM is not included in this table; this is because it is available only in a subset of datasets

  • Given the results reported above, our proposed ensemble FUS1 should prove useful for practitioners and experts alike since it can form the base for building systems that are optimized for particular problems (e.g., support vector machine (SVM) optimization and physicochemical properties selection)

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Summary

Introduction

The explosion of protein sequences generated in the postgenomic era has not been followed by an equal increase in the knowledge of protein biological attributes, which are essential for basic research and drug development. Since manual classification of proteins by means of biological experiments is both time-consuming and costly, much effort has been applied to the problem of automating this process using various machine learning algorithms and computational tools for fast and effective classification of proteins given their sequence information [1]. According to [2], a process designed to predict an attribute of a protein based on its sequence generally involves the following procedures: (1) constructing a benchmark dataset for testing and training machine learning predictors, (2) formulating a protein representation based on a discrete numerical model that is correlated with the attribute to predict, (3) proposing a powerful machine learning approach to perform the prediction, (4). The most widely used sequential model is based on the entire amino-acid sequence of a protein, expressed by the sequence of its residues, with each one belonging to one of the 20 native amino-acid types:

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