Performance Analysis
An Aggregation Method for Sparse Logistic Regression
$L_1$ regularized logistic regression has now become a workhorse of data mining and bioinformatics: it is widely used for many classification problems, particularly ones with many features. However, $L_1$ regularization typically selects too many features and that so-called false positives are unavoidable. In this paper, we demonstrate and analyze an aggregation method for sparse logistic regression in high dimensions. This approach linearly combines the estimators from a suitable set of logistic models with different underlying sparsity patterns and can balance the predictive ability and model interpretability. Numerical performance of our proposed aggregation method is then investigated using simulation studies. We also analyze a published genome-wide case-control dataset to further evaluate the usefulness of the aggregation method in multilocus association mapping.
Massively Multitask Networks for Drug Discovery
Ramsundar, Bharath, Kearnes, Steven, Riley, Patrick, Webster, Dale, Konerding, David, Pande, Vijay
Massively multitask neural architectures provide a learning framework for drug discovery that synthesizes information from many distinct biological sources. To train these architectures at scale, we gather large amounts of data from public sources to create a dataset of nearly 40 million measurements across more than 200 biological targets. We investigate several aspects of the multitask framework by performing a series of empirical studies and obtain some interesting results: (1) massively multitask networks obtain predictive accuracies significantly better than single-task methods, (2) the predictive power of multitask networks improves as additional tasks and data are added, (3) the total amount of data and the total number of tasks both contribute significantly to multitask improvement, and (4) multitask networks afford limited transferability to tasks not in the training set. Our results underscore the need for greater data sharing and further algorithmic innovation to accelerate the drug discovery process.
Cascading Randomized Weighted Majority: A New Online Ensemble Learning Algorithm
Zamani, Mohammadzaman, Beigy, Hamid, Shaban, Amirreza
With the increasing volume of data in the world, the best approach for learning from this data is to exploit an online learning algorithm. Online ensemble methods are online algorithms which take advantage of an ensemble of classifiers to predict labels of data. Prediction with expert advice is a well-studied problem in the online ensemble learning literature. The Weighted Majority algorithm and the randomized weighted majority (RWM) are the most well-known solutions to this problem, aiming to converge to the best expert. Since among some expert, the best one does not necessarily have the minimum error in all regions of data space, defining specific regions and converging to the best expert in each of these regions will lead to a better result. In this paper, we aim to resolve this defect of RWM algorithms by proposing a novel online ensemble algorithm to the problem of prediction with expert advice. We propose a cascading version of RWM to achieve not only better experimental results but also a better error bound for sufficiently large datasets.
Feature Selection with Redundancy-complementariness Dispersion
Chen, Zhijun, Wu, Chaozhong, Zhang, Yishi, Huang, Zhen, Ran, Bin, Zhong, Ming, Lyu, Nengchao
Feature selection has attracted significant attention in data mining and machine learning in the past decades. Many existing feature selection methods eliminate redundancy by measuring pairwise inter-correlation of features, whereas the complementariness of features and higher inter-correlation among more than two features are ignored. In this study, a modification item concerning the complementariness of features is introduced in the evaluation criterion of features. Additionally, in order to identify the interference effect of already-selected False Positives (FPs), the redundancy-complementariness dispersion is also taken into account to adjust the measurement of pairwise inter-correlation of features. To illustrate the effectiveness of proposed method, classification experiments are applied with four frequently used classifiers on ten datasets. Classification results verify the superiority of proposed method compared with five representative feature selection methods.
A New Intelligence Based Approach for Computer-Aided Diagnosis of Dengue Fever
Rao, Vadrevu Sree Hari, Kumar, Mallenahalli Naresh
Identification of the influential clinical symptoms and laboratory features that help in the diagnosis of dengue fever in early phase of the illness would aid in designing effective public health management and virological surveillance strategies. Keeping this as our main objective we develop in this paper, a new computational intelligence based methodology that predicts the diagnosis in real time, minimizing the number of false positives and false negatives. Our methodology consists of three major components (i) a novel missing value imputation procedure that can be applied on any data set consisting of categorical (nominal) and/or numeric (real or integer) (ii) a wrapper based features selection method with genetic search for extracting a subset of most influential symptoms that can diagnose the illness and (iii) an alternating decision tree method that employs boosting for generating highly accurate decision rules. The predictive models developed using our methodology are found to be more accurate than the state-of-the-art methodologies used in the diagnosis of the dengue fever.
Understanding Kernel Ridge Regression: Common behaviors from simple functions to density functionals
Vu, Kevin, Snyder, John, Li, Li, Rupp, Matthias, Chen, Brandon F., Khelif, Tarek, Mรผller, Klaus-Robert, Burke, Kieron
Accurate approximations to density functionals have recently been obtained via machine learning (ML). By applying ML to a simple function of one variable without any random sampling, we extract the qualitative dependence of errors on hyperparameters. We find universal features of the behavior in extreme limits, including both very small and very large length scales, and the noise-free limit. We show how such features arise in ML models of density functionals.
MACHINE INTELLIGENCE 13
The two outstanding figures in the history of computer science are Alan Turing and John von Neumann, and they shared the view that logic was the key to understanding and automating computation. In particular, it was Turing who gave us in the mid-1930s the fundamental analysis, and the logical definition, of the concept of'computability by machine' and who discovered the surprising and beautiful basic fact that there exist universal machines which by suitable programming can be made to t This essay is an expanded and revised version of one entitled The Role of Logic in Computer Science and Artificial Intelligence, which was completed in January 1992 (and was later published in the Proceedings of the Fifth Generation computer Systems 1992 Conference). Since completing that essay I have had the benefit of extremely helpful discussions on many of the details with Professor Donald Michie and Professor I. J. Good, both of whom knew Turing well during the war years at Bletchley Park. Professor J. A. N. Lee, whose knowledge of the literature and archives of the history of computing is encyclopedic, also provided additional information, some of which is still unpublished. Further light has very recently been shed on the von Neumann side of the story by Norman Macrae's excellent biography John von Neumann (Macrae 1992). Accordingly, it seemed appropriate to undertake a more complete and thorough version of the FGCS'92 essay, focussing somewhat more on the interesting historical and biographical issues. I am grateful to Donald Michie and Stephen Muggleton for inviting me to contribute such a'second edition' to the present volume, and I would also like to thank the Institute for New Computer Technology (ICOT) for kind permission to make use of the FGCS'92 essay in this way. 1 LOGIC, COMPUTERS, TURING, AND VON NEUMANN
MACHINE INTELLIGENCE 11
In this paper we will be concerned with such reasoning in its most general form, that is, in inferences that are defeasible: given more information, we may retract them. The purpose of this paper is to introduce a form of non-monotonic inference based on the notion of a partial model of the world. We take partial models to reflect our partial knowledge of the true state of affairs. We then define non-monotonic inference as the process of filling in unknown parts of the model with conjectures: statements that could turn out to be false, given more complete knowledge. To take a standard example from default reasoning: since most birds can fly, if Tweety is a bird it is reasonable to assume that she can fly, at least in the absence of any information to the contrary. We thus have some justification for filling in our partial picture of the world with this conjecture. If our knowledge includes the fact that Tweety is an ostrich, then no such justification exists, and the conjecture must be retracted.
6 Integrating AI with Sequence Analysis Richard Lathrop, Teresa Webster, Randall Smith, Patrick Winston & Temple Smith
This chapter will discuss one example of how AI techniques are being integrated with, and extending, existing molecular biology sequence analysis methods. AI ideas of complex representations, pattern recognition, search, and machine learning have been applied to the task of inferring and recognizing structural patterns associated with molecular function. We wish to construct such patterns, and to recognize them in unknown molecules, based on information inferred solely from protein primary (amino acid) sequences.
22 Question Answering BONNIE WEBBER AND NICK WEBB
Questions are asked and answered every day. Question answering (QA) technology aims to deliver the same facility online. It goes further than the more familiar search based on keywords (as in Google, Yahoo, and other search engines), in attempting to recognize what a question expresses and to respond with an actual answer. First, questions do not often translate into a simple list of keywords. For example, the question (1) Which countries did the pope visit in the 1960s? A much more complex set of keywords is needed in order to get anywhere close to the intended result, and experience shows that people will not learn how to formulate and use such sets. Second, QA takes responsibility for providing answers, rather than a searchable list of links to potentially relevant documents (web pages), highlighted by snippets of text that show how the query matched the documents. While this is not much of a burden when the answer appears in a snippet and further document access is unnecessary, QA technology aims to move this from being an accidental property of search to its focus. In keyword search and in much work to date on QA technology, the information seeking process has been seen as a one-shot affair: the user asks a question, and the system provides a satisfactory response. However, early work on QA (Section 1.1) did not make this assumption, and newly targeted applications are hindered by it: while a user may try to formulate a question whose answer is the information Question Answering 631 they want, they will not know whether they have succeeded until something has been returned for examination. If what is returned is unsatisfactory or, while not the answer, is still of interest, a user needs to be able to ask further questions that are understood in the context of the previous ones. For these target applications, QA must be part of a collaborative search process (Section 3.3). In the rest of this section, we give some historical background on QA systems (Section 1.1), on dialogue systems in which QA has played a significant role (Section 1.2), and on a particular QA task that has been a major driver of the field over the past 8 years (Section 1.3). Section 2 describes the current state of the art in QA systems, organized around the de facto architecture of such systems. Section 3 discusses some current directions in which QA is moving, including the development of interactive QA.