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2006


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Prediction of Protein Function from Networks

Shin, H., Tsuda, K.

In Semi-Supervised Learning, pages: 361-376, Adaptive Computation and Machine Learning, (Editors: Chapelle, O. , B. Schölkopf, A. Zien), MIT Press, Cambridge, MA, USA, November 2006 (inbook)

Abstract
In computational biology, it is common to represent domain knowledge using graphs. Frequently there exist multiple graphs for the same set of nodes, representing information from different sources, and no single graph is sufficient to predict class labels of unlabelled nodes reliably. One way to enhance reliability is to integrate multiple graphs, since individual graphs are partly independent and partly complementary to each other for prediction. In this chapter, we describe an algorithm to assign weights to multiple graphs within graph-based semi-supervised learning. Both predicting class labels and searching for weights for combining multiple graphs are formulated into one convex optimization problem. The graph-combining method is applied to functional class prediction of yeast proteins.When compared with individual graphs, the combined graph with optimized weights performs significantly better than any single graph.When compared with the semidefinite programming-based support vector machine (SDP/SVM), it shows comparable accuracy in a remarkably short time. Compared with a combined graph with equal-valued weights, our method could select important graphs without loss of accuracy, which implies the desirable property of integration with selectivity.

ei

Web [BibTex]

2006


Web [BibTex]


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Discrete Regularization

Zhou, D., Schölkopf, B.

In Semi-supervised Learning, pages: 237-250, Adaptive computation and machine learning, (Editors: O Chapelle and B Schölkopf and A Zien), MIT Press, Cambridge, MA, USA, November 2006 (inbook)

Abstract
Many real-world machine learning problems are situated on finite discrete sets, including dimensionality reduction, clustering, and transductive inference. A variety of approaches for learning from finite sets has been proposed from different motivations and for different problems. In most of those approaches, a finite set is modeled as a graph, in which the edges encode pairwise relationships among the objects in the set. Consequently many concepts and methods from graph theory are adopted. In particular, the graph Laplacian is widely used. In this chapter we present a systemic framework for learning from a finite set represented as a graph. We develop discrete analogues of a number of differential operators, and then construct a discrete analogue of classical regularization theory based on those discrete differential operators. The graph Laplacian based approaches are special cases of this general discrete regularization framework. An important thing implied in this framework is that we have a wide choices of regularization on graph in addition to the widely-used graph Laplacian based one.

ei

PDF Web [BibTex]

PDF Web [BibTex]


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Kernel PCA for Image Compression

Huhle, B.

Biologische Kybernetik, Eberhard-Karls-Universität, Tübingen, Germany, April 2006 (diplomathesis)

ei

PDF [BibTex]

PDF [BibTex]


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Gaussian Process Models for Robust Regression, Classification, and Reinforcement Learning

Kuss, M.

Biologische Kybernetik, Technische Universität Darmstadt, Darmstadt, Germany, March 2006, passed with distinction, published online (phdthesis)

ei

PDF [BibTex]

PDF [BibTex]


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Combining a Filter Method with SVMs

Lal, T., Chapelle, O., Schölkopf, B.

In Feature Extraction: Foundations and Applications, Studies in Fuzziness and Soft Computing, Vol. 207, pages: 439-446, Studies in Fuzziness and Soft Computing ; 207, (Editors: I Guyon and M Nikravesh and S Gunn and LA Zadeh), Springer, Berlin, Germany, 2006 (inbook)

Abstract
Our goal for the competition (feature selection competition NIPS 2003) was to evaluate the usefulness of simple machine learning techniques. We decided to use the correlation criteria as a feature selection method and Support Vector Machines for the classification part. Here we explain how we chose the regularization parameter C of the SVM, how we determined the kernel parameter and how we estimated the number of features used for each data set. All analyzes were carried out on the training sets of the competition data. We choose the data set Arcene as an example to explain the approach step by step. In our view the point of this competition was the construction of a well performing classifier rather than the systematic analysis of a specific approach. This is why our search for the best classifier was only guided by the described methods and that we deviated from the road map at several occasions. All calculations were done with the software Spider [2004].

ei

PDF DOI [BibTex]

PDF DOI [BibTex]


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Embedded methods

Lal, T., Chapelle, O., Weston, J., Elisseeff, A.

In Feature Extraction: Foundations and Applications, pages: 137-165, Studies in Fuzziness and Soft Computing ; 207, (Editors: Guyon, I. , S. Gunn, M. Nikravesh, L. A. Zadeh), Springer, Berlin, Germany, 2006 (inbook)

Abstract
Embedded methods are a relatively new approach to feature selection. Unlike filter methods, which do not incorporate learning, and wrapper approaches, which can be used with arbitrary classifiers, in embedded methods the features selection part can not be separated from the learning part. Existing embedded methods are reviewed based on a unifying mathematical framework.

ei

PDF Web [BibTex]

PDF Web [BibTex]


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NONLINEAR OPTICAL PROPERTIES OF CHIRAL LIQUIDS Electric-dipolar pseudoscalars in nonlinear optics

Fischer, P., Champagne, B.

In NON-LINEAR OPTICAL PROPERTIES OF MATTER: FROM MOLECULES TO CONDENSED PHASES, 1, pages: 359-381, Challenges and Advances in Computational Chemistry and Physics, 2006 (incollection)

Abstract
We give all overview of linear and nonlinear optical processes that can be specific to chiral molecules in isotropic media. Specifically, we discuss the pseudoscalars that underlie nonlinear optical activity and chiral frequency conversion processes in fluids. We show that nonlinear optical techniques open entirely new ways of exploring chirality: Sum-frequency-generation (SFG) at second-order and BioCARS at fourth-order arise in the electric-dipole approximation and do not require circularly polarized light to detect chiral molecules in solution. Here the frequency conversion in itself is a measure of chirality. This is in contrast to natural optical activity phenomena which are based on the interference of radiation from induced oscillating electric and magnetic dipoles, and which are observed as a differential response to right and left circularly polarized light. We give examples from our SFG experiments in optically active solutions and show how the application of an additional static electric field to sum-frequency generation allows the absolute configuration of the chiral solute to be determined via all electric-dipolar process. Results from ab initio calculations of the SFG pseudoscalar are presented for a number of chiral molecules

pf

[BibTex]

[BibTex]


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Elektronentheorie der magnetischen EXAFS

Gü\ssmann, M.

Universität Stuttgart, Stuttgart, 2006 (mastersthesis)

mms

[BibTex]

[BibTex]


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Approximate nearest neighbor regression in very high dimensions

Vijayakumar, S., DSouza, A., Schaal, S.

In Nearest-Neighbor Methods in Learning and Vision, pages: 103-142, (Editors: Shakhnarovich, G.;Darrell, T.;Indyk, P.), Cambridge, MA: MIT Press, 2006, clmc (inbook)

am

link (url) [BibTex]

link (url) [BibTex]


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Elektronenspektroskopie an Übergangsmetallclustern

He\ssler, M.

Bayerische Julius-Maximilians-Universität, Würzburg, 2006 (phdthesis)

mms

[BibTex]

[BibTex]


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Hydrogen storage by physisorption on porous materials

Panella, B.

Universität Stuttgart, Stuttgart, 2006 (phdthesis)

mms

link (url) [BibTex]

link (url) [BibTex]


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Theory of magnetic x-ray reflectometry on the Co2Pt7 multilayer system

Martosiswoyo, L.

Universität Stuttgart, Stuttgart, 2006 (mastersthesis)

mms

[BibTex]

[BibTex]


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Magnetischer zirkularer Röntgendichroismus an Übergangsmetalloxiden

Lafkioti, M.

Universität Stuttgart, Stuttgart, 2006 (mastersthesis)

mms

[BibTex]

[BibTex]


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Contributions to the theory of x-ray magnetic dichroism

Dörfler, F.

Universität Stuttgart, Stuttgart, 2006 (mastersthesis)

mms

[BibTex]

[BibTex]

2005


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Extension to Kernel Dependency Estimation with Applications to Robotics

BakIr, G.

Biologische Kybernetik, Technische Universität Berlin, Berlin, November 2005 (phdthesis)

Abstract
Kernel Dependency Estimation(KDE) is a novel technique which was designed to learn mappings between sets without making assumptions on the type of the involved input and output data. It learns the mapping in two stages. In a first step, it tries to estimate coordinates of a feature space representation of elements of the set by solving a high dimensional multivariate regression problem in feature space. Following this, it tries to reconstruct the original representation given the estimated coordinates. This thesis introduces various algorithmic extensions to both stages in KDE. One of the contributions of this thesis is to propose a novel linear regression algorithm that explores low-dimensional subspaces during learning. Furthermore various existing strategies for reconstructing patterns from feature maps involved in KDE are discussed and novel pre-image techniques are introduced. In particular, pre-image techniques for data-types that are of discrete nature such as graphs and strings are investigated. KDE is then explored in the context of robot pose imitation where the input is a an image with a human operator and the output is the robot articulated variables. Thus, using KDE, robot pose imitation is formulated as a regression problem.

ei

PDF PDF [BibTex]

2005


PDF PDF [BibTex]


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Geometrical aspects of statistical learning theory

Hein, M.

Biologische Kybernetik, Darmstadt, Darmstadt, November 2005 (phdthesis)

ei

PDF [BibTex]

PDF [BibTex]


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Implicit Surfaces For Modelling Human Heads

Steinke, F.

Biologische Kybernetik, Eberhard-Karls-Universität, Tübingen, September 2005 (diplomathesis)

ei

[BibTex]

[BibTex]


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Machine Learning Methods for Brain-Computer Interdaces

Lal, TN.

Biologische Kybernetik, University of Darmstadt, September 2005 (phdthesis)

ei

Web [BibTex]

Web [BibTex]


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Efficient Adaptive Sampling of the Psychometric Function by Maximizing Information Gain

Tanner, TG.

Biologische Kybernetik, Eberhard-Karls University Tübingen, Tübingen, Germany, May 2005 (diplomathesis)

Abstract
A common task in psychophysics is to measure the psychometric function. A psychometric function can be described by its shape and four parameters: offset or threshold, slope or width, false alarm rate or chance level and miss or lapse rate. Depending on the parameters of interest some points on the psychometric function may be more informative than others. Adaptive methods attempt to place trials on the most informative points based on the data collected in previous trials. A new Bayesian adaptive psychometric method placing trials by minimising the expected entropy of the posterior probabilty dis- tribution over a set of possible stimuli is introduced. The method is more flexible, faster and at least as efficient as the established method (Kontsevich and Tyler, 1999). Comparably accurate (2dB) threshold and slope estimates can be obtained after about 30 and 500 trials, respectively. By using a dynamic termination criterion the efficiency can be further improved. The method can be applied to all experimental designs including yes/no designs and allows acquisition of any set of free parameters. By weighting the importance of parameters one can include nuisance parameters and adjust the relative expected errors. Use of nuisance parameters may lead to more accurate estimates than assuming a guessed fixed value. Block designs are supported and do not harm the performance if a sufficient number of trials are performed. The method was evaluated by computer simulations in which the role of parametric assumptions, its robustness, the quality of different point estimates, the effect of dynamic termination criteria and many other settings were investigated.

ei

[BibTex]

[BibTex]


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Support Vector Machines and Kernel Algorithms

Schölkopf, B., Smola, A.

In Encyclopedia of Biostatistics (2nd edition), Vol. 8, 8, pages: 5328-5335, (Editors: P Armitage and T Colton), John Wiley & Sons, NY USA, 2005 (inbook)

ei

[BibTex]

[BibTex]


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Visual perception I: Basic principles

Wagemans, J., Wichmann, F., de Beeck, H.

In Handbook of Cognition, pages: 3-47, (Editors: Lamberts, K. , R. Goldstone), Sage, London, 2005 (inbook)

ei

[BibTex]

[BibTex]


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Untersuchung über die Grenzflächenmagnetisierung an (FM) Kobalt- und (AFM) Eisen-Mangan-Schichten

Harlander, M.

Stuttgart, Universität Stuttgart, 2005 (mastersthesis)

mms

[BibTex]

[BibTex]


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Geckobot and waalbot: Small-scale wall climbing robots

Unver, O., Murphy, M., Sitti, M.

In Infotech@ Aerospace, pages: 6940, 2005 (incollection)

pi

[BibTex]

[BibTex]

2004


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Distributed Command Execution

Stark, S., Berlin, M.

In BSD Hacks: 100 industrial-strength tips & tools, pages: 152-152, (Editors: Lavigne, Dru), O’Reilly, Beijing, May 2004 (inbook)

Abstract
Often you want to execute a command not only on one computer, but on several at once. For example, you might want to report the current statistics on a group of managed servers or update all of your web servers at once.

ei

[BibTex]

2004


[BibTex]


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Gaussian Processes in Machine Learning

Rasmussen, CE.

In 3176, pages: 63-71, Lecture Notes in Computer Science, (Editors: Bousquet, O., U. von Luxburg and G. Rätsch), Springer, Heidelberg, 2004, Copyright by Springer (inbook)

Abstract
We give a basic introduction to Gaussian Process regression models. We focus on understanding the role of the stochastic process and how it is used to define a distribution over functions. We present the simple equations for incorporating training data and examine how to learn the hyperparameters using the marginal likelihood. We explain the practical advantages of Gaussian Process and end with conclusions and a look at the current trends in GP work.

ei

PDF PostScript [BibTex]

PDF PostScript [BibTex]


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Protein Classification via Kernel Matrix Completion

Kin, T., Kato, T., Tsuda, K.

In pages: 261-274, (Editors: Schoelkopf, B., K. Tsuda and J.P. Vert), MIT Press, Cambridge, MA; USA, 2004 (inbook)

ei

PDF [BibTex]

PDF [BibTex]


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Statistical Learning with Similarity and Dissimilarity Functions

von Luxburg, U.

pages: 1-166, Technische Universität Berlin, Germany, Technische Universität Berlin, Germany, 2004 (phdthesis)

ei

PDF PostScript [BibTex]

PDF PostScript [BibTex]


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Introduction to Statistical Learning Theory

Bousquet, O., Boucheron, S., Lugosi, G.

In Lecture Notes in Artificial Intelligence 3176, pages: 169-207, (Editors: Bousquet, O., U. von Luxburg and G. Rätsch), Springer, Heidelberg, Germany, 2004 (inbook)

ei

PDF [BibTex]

PDF [BibTex]


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A Primer on Kernel Methods

Vert, J., Tsuda, K., Schölkopf, B.

In Kernel Methods in Computational Biology, pages: 35-70, (Editors: B Schölkopf and K Tsuda and JP Vert), MIT Press, Cambridge, MA, USA, 2004 (inbook)

ei

PDF [BibTex]

PDF [BibTex]


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Classification and Feature Extraction in Man and Machine

Graf, AAB.

Biologische Kybernetik, University of Tübingen, Germany, 2004, online publication (phdthesis)

ei

[BibTex]

[BibTex]


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Concentration Inequalities

Boucheron, S., Lugosi, G., Bousquet, O.

In Lecture Notes in Artificial Intelligence 3176, pages: 208-240, (Editors: Bousquet, O., U. von Luxburg and G. Rätsch), Springer, Heidelberg, Germany, 2004 (inbook)

ei

PDF [BibTex]

PDF [BibTex]


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Kernels for graphs

Kashima, H., Tsuda, K., Inokuchi, A.

In pages: 155-170, (Editors: Schoelkopf, B., K. Tsuda and J.P. Vert), MIT Press, Cambridge, MA; USA, 2004 (inbook)

ei

PDF [BibTex]

PDF [BibTex]


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A primer on molecular biology

Zien, A.

In pages: 3-34, (Editors: Schoelkopf, B., K. Tsuda and J. P. Vert), MIT Press, Cambridge, MA, USA, 2004 (inbook)

Abstract
Modern molecular biology provides a rich source of challenging machine learning problems. This tutorial chapter aims to provide the necessary biological background knowledge required to communicate with biologists and to understand and properly formalize a number of most interesting problems in this application domain. The largest part of the chapter (its first section) is devoted to the cell as the basic unit of life. Four aspects of cells are reviewed in sequence: (1) the molecules that cells make use of (above all, proteins, RNA, and DNA); (2) the spatial organization of cells (``compartmentalization''); (3) the way cells produce proteins (``protein expression''); and (4) cellular communication and evolution (of cells and organisms). In the second section, an overview is provided of the most frequent measurement technologies, data types, and data sources. Finally, important open problems in the analysis of these data (bioinformatics challenges) are briefly outlined.

ei

PDF PostScript Web [BibTex]

PDF PostScript Web [BibTex]


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Investigation of oxide layers in tunnel junctions

Amaladass, E. P.

University of Stuttgart, Stuttgart, 2004 (mastersthesis)

mms

[BibTex]

[BibTex]


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Untersuchung der Desorptionskinetik von Metallhydriden in Bezug auf technische Anwendungen

von Zeppelin, F.

Universität Stuttgart, Stuttgart, 2004 (phdthesis)

mms

[BibTex]

[BibTex]


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Towards Tractable Parameter-Free Statistical Learning (Phd Thesis)

D’Souza, A

Department of Computer Science, University of Southern California, Los Angeles, 2004, clmc (phdthesis)

am

link (url) [BibTex]

link (url) [BibTex]


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Dynamik von Wasserstoff in nanokristallinen Systemen

Stanik, E.

Universität Stuttgart, Stuttgart, 2004 (phdthesis)

mms

[BibTex]

[BibTex]


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Inselwachstum auf Festkörperoberflächen unter Ionenbestrahlung

Frank, A.

Universität Stuttgart, Stuttgart, 2004 (phdthesis)

mms

link (url) [BibTex]

link (url) [BibTex]


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Flusslinienverankerung in HTSL-Schichten mit kontrollierter Defektstruktur im Nanometerbereich

Leonhardt, S.

Universität Stuttgart, Stuttgart, 2004 (phdthesis)

mms

[BibTex]

[BibTex]


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Investigation of the stability of metals on polymers

Amoako, G.

University of Stuttgart, Stuttgart, 2004 (mastersthesis)

mms

[BibTex]

[BibTex]


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Flusslinienverankerung in Hochtemperatursupraleitern auf nanostrukturierten Substraten

Brück, S.

Universität Stuttgart, Stuttgart, 2004 (mastersthesis)

mms

[BibTex]

[BibTex]


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Ionenstreuung mit Monolagen-Tiefenauflösung

Olliges, S.

Universität Stuttgart, Stuttgart, 2004 (mastersthesis)

mms

[BibTex]

[BibTex]


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Computational approaches to motor learning by imitation

Schaal, S., Ijspeert, A., Billard, A.

In The Neuroscience of Social Interaction, (1431):199-218, (Editors: Frith, C. D.;Wolpert, D.), Oxford University Press, Oxford, 2004, clmc (inbook)

Abstract
Movement imitation requires a complex set of mechanisms that map an observed movement of a teacher onto one's own movement apparatus. Relevant problems include movement recognition, pose estimation, pose tracking, body correspondence, coordinate transformation from external to egocentric space, matching of observed against previously learned movement, resolution of redundant degrees-of-freedom that are unconstrained by the observation, suitable movement representations for imitation, modularization of motor control, etc. All of these topics by themselves are active research problems in computational and neurobiological sciences, such that their combination into a complete imitation system remains a daunting undertaking - indeed, one could argue that we need to understand the complete perception-action loop. As a strategy to untangle the complexity of imitation, this paper will examine imitation purely from a computational point of view, i.e. we will review statistical and mathematical approaches that have been suggested for tackling parts of the imitation problem, and discuss their merits, disadvantages and underlying principles. Given the focus on action recognition of other contributions in this special issue, this paper will primarily emphasize the motor side of imitation, assuming that a perceptual system has already identified important features of a demonstrated movement and created their corresponding spatial information. Based on the formalization of motor control in terms of control policies and their associated performance criteria, useful taxonomies of imitation learning can be generated that clarify different approaches and future research directions.

am

link (url) [BibTex]

link (url) [BibTex]


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Untersuchungen zum Magnetismus von Clustern und Nanopartikeln und zum Einfluss der Wechselwirkung mit ihrer Umgebung

Fauth, Kai

Julius-Maximilians-Universität Würzburg, Würzburg, 2004 (phdthesis)

mms

[BibTex]

[BibTex]


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Effect of Grain Boundary Phase Transitions on the Superplasticity in the Al-Zn System

Lopez, G.A., Straumal, B.B., Gust, W., Mittemeijer, E.J.

In Nanomaterials by Severe Plastic Deformation, pages: 642-647, Wiley-VCH Verlag, Weinheim, 2004 (incollection)

mms

[BibTex]

[BibTex]