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2019


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Neural Signatures of Motor Skill in the Resting Brain

Ozdenizci, O., Meyer, T., Wichmann, F., Peters, J., Schölkopf, B., Cetin, M., Grosse-Wentrup, M.

Proceedings of the IEEE International Conference on Systems, Man and Cybernetics (SMC 2019), October 2019 (conference) Accepted

[BibTex]

2019

[BibTex]


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Beta Power May Mediate the Effect of Gamma-TACS on Motor Performance

Mastakouri, A., Schölkopf, B., Grosse-Wentrup, M.

Engineering in Medicine and Biology Conference (EMBC), July 2019 (conference) Accepted

arXiv PDF [BibTex]

arXiv PDF [BibTex]


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Kernel Mean Matching for Content Addressability of GANs

Jitkrittum*, W., Sangkloy*, P., Gondal, M. W., Raj, A., Hays, J., Schölkopf, B.

Proceedings of the 36th International Conference on Machine Learning (ICML), 97, pages: 3140-3151, Proceedings of Machine Learning Research, (Editors: Chaudhuri, Kamalika and Salakhutdinov, Ruslan), PMLR, June 2019, *equal contribution (conference)

PDF link (url) [BibTex]

PDF link (url) [BibTex]


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Challenging Common Assumptions in the Unsupervised Learning of Disentangled Representations

Locatello, F., Bauer, S., Lucic, M., Raetsch, G., Gelly, S., Schölkopf, B., Bachem, O.

Proceedings of the 36th International Conference on Machine Learning (ICML), 97, pages: 4114-4124, Proceedings of Machine Learning Research, (Editors: Chaudhuri, Kamalika and Salakhutdinov, Ruslan), PMLR, June 2019 (conference)

PDF link (url) [BibTex]

PDF link (url) [BibTex]


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Local Temporal Bilinear Pooling for Fine-grained Action Parsing

Zhang, Y., Tang, S., Muandet, K., Jarvers, C., Neumann, H.

In Proceedings IEEE Conf. on Computer Vision and Pattern Recognition (CVPR), IEEE International Conference on Computer Vision and Pattern Recognition (CVPR) 2019, June 2019 (inproceedings)

Abstract
Fine-grained temporal action parsing is important in many applications, such as daily activity understanding, human motion analysis, surgical robotics and others requiring subtle and precise operations in a long-term period. In this paper we propose a novel bilinear pooling operation, which is used in intermediate layers of a temporal convolutional encoder-decoder net. In contrast to other work, our proposed bilinear pooling is learnable and hence can capture more complex local statistics than the conventional counterpart. In addition, we introduce exact lower-dimension representations of our bilinear forms, so that the dimensionality is reduced with neither information loss nor extra computation. We perform intensive experiments to quantitatively analyze our model and show the superior performances to other state-of-the-art work on various datasets.

Code video demo pdf link (url) [BibTex]

Code video demo pdf link (url) [BibTex]


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Generate Semantically Similar Images with Kernel Mean Matching

Jitkrittum*, W., Sangkloy*, P., Gondal, M. W., Raj, A., Hays, J., Schölkopf, B.

6th Workshop Women in Computer Vision (WiCV) (oral presentation), June 2019, *equal contribution (conference) Accepted

[BibTex]

[BibTex]


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Robustly Disentangled Causal Mechanisms: Validating Deep Representations for Interventional Robustness

Suter, R., Miladinovic, D., Schölkopf, B., Bauer, S.

Proceedings of the 36th International Conference on Machine Learning (ICML), 97, pages: 6056-6065, Proceedings of Machine Learning Research, (Editors: Chaudhuri, Kamalika and Salakhutdinov, Ruslan), PMLR, June 2019 (conference)

PDF link (url) [BibTex]

PDF link (url) [BibTex]


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First-Order Adversarial Vulnerability of Neural Networks and Input Dimension

Simon-Gabriel, C., Ollivier, Y., Bottou, L., Schölkopf, B., Lopez-Paz, D.

Proceedings of the 36th International Conference on Machine Learning (ICML), 97, pages: 5809-5817, Proceedings of Machine Learning Research, (Editors: Chaudhuri, Kamalika and Salakhutdinov, Ruslan), PMLR, June 2019 (conference)

PDF link (url) [BibTex]

PDF link (url) [BibTex]


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Overcoming Mean-Field Approximations in Recurrent Gaussian Process Models

Ialongo, A. D., Van Der Wilk, M., Hensman, J., Rasmussen, C. E.

In Proceedings of the 36th International Conference on Machine Learning (ICML), 97, pages: 2931-2940, Proceedings of Machine Learning Research, (Editors: Chaudhuri, Kamalika and Salakhutdinov, Ruslan), PMLR, June 2019 (inproceedings)

PDF link (url) [BibTex]

PDF link (url) [BibTex]


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Meta learning variational inference for prediction

Gordon, J., Bronskill, J., Bauer, M., Nowozin, S., Turner, R.

7th International Conference on Learning Representations (ICLR), May 2019 (conference) Accepted

arXiv link (url) [BibTex]

arXiv link (url) [BibTex]


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Deep Lagrangian Networks: Using Physics as Model Prior for Deep Learning

Lutter, M., Ritter, C., Peters, J.

7th International Conference on Learning Representations (ICLR), May 2019 (conference) Accepted

link (url) [BibTex]

link (url) [BibTex]


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DeepOBS: A Deep Learning Optimizer Benchmark Suite

Schneider, F., Balles, L., Hennig, P.

7th International Conference on Learning Representations (ICLR), May 2019 (conference) Accepted

link (url) [BibTex]

link (url) [BibTex]


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Disentangled State Space Models: Unsupervised Learning of Dynamics across Heterogeneous Environments

Miladinović*, D., Gondal*, M. W., Schölkopf, B., Buhmann, J. M., Bauer, S.

Deep Generative Models for Highly Structured Data Workshop at ICLR, May 2019, *equal contribution (conference) Accepted

link (url) [BibTex]

link (url) [BibTex]


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SOM-VAE: Interpretable Discrete Representation Learning on Time Series

Fortuin, V., Hüser, M., Locatello, F., Strathmann, H., Rätsch, G.

7th International Conference on Learning Representations (ICLR), May 2019 (conference) Accepted

link (url) [BibTex]

link (url) [BibTex]


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Resampled Priors for Variational Autoencoders

Bauer, M., Mnih, A.

22nd International Conference on Artificial Intelligence and Statistics, April 2019 (conference) Accepted

arXiv [BibTex]

arXiv [BibTex]


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Semi-Generative Modelling: Covariate-Shift Adaptation with Cause and Effect Features

von Kügelgen, J., Mey, A., Loog, M.

22nd International Conference on Artificial Intelligence and Statistics (AISTATS), April 2019 (conference) Accepted

[BibTex]

[BibTex]


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Sobolev Descent

Mroueh, Y., Sercu, T., Raj, A.

22nd International Conference on Artificial Intelligence and Statistics (AISTATS), April 2019 (conference) Accepted

[BibTex]

[BibTex]


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Fast and Robust Shortest Paths on Manifolds Learned from Data

Arvanitidis, G., Hauberg, S., Hennig, P., Schober, M.

22nd International Conference on Artificial Intelligence and Statistics (AISTATS), April 2019 (conference) Accepted

[BibTex]

[BibTex]


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Data scarcity, robustness and extreme multi-label classification

Babbar, R., Schölkopf, B.

Machine Learning, Special Issue of the ECML PKDD 2019 Journal Track, March 2019 (article)

DOI [BibTex]

DOI [BibTex]


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Learning Transferable Representations

Rojas-Carulla, M.

University of Cambridge, UK, 2019 (phdthesis)

[BibTex]

[BibTex]


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Sample-efficient deep reinforcement learning for continuous control

Gu, S.

University of Cambridge, UK, 2019 (phdthesis)

[BibTex]


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Enhancing Human Learning via Spaced Repetition Optimization

Tabibian, B., Upadhyay, U., De, A., Zarezade, A., Schölkopf, B., Gomez Rodriguez, M.

Proceedings of the National Academy of Sciences, 2019, PNAS published ahead of print January 22, 2019 (article)

DOI Project Page Project Page [BibTex]

DOI Project Page Project Page [BibTex]


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Spatial Filtering based on Riemannian Manifold for Brain-Computer Interfacing

Xu, J.

Technical University of Munich, Germany, 2019 (mastersthesis)

[BibTex]

[BibTex]


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Learning to Control Highly Accelerated Ballistic Movements on Muscular Robots

Büchler, D., Calandra, R., Peters, J.

2019 (article) Submitted

Abstract
High-speed and high-acceleration movements are inherently hard to control. Applying learning to the control of such motions on anthropomorphic robot arms can improve the accuracy of the control but might damage the system. The inherent exploration of learning approaches can lead to instabilities and the robot reaching joint limits at high speeds. Having hardware that enables safe exploration of high-speed and high-acceleration movements is therefore desirable. To address this issue, we propose to use robots actuated by Pneumatic Artificial Muscles (PAMs). In this paper, we present a four degrees of freedom (DoFs) robot arm that reaches high joint angle accelerations of up to 28000 °/s^2 while avoiding dangerous joint limits thanks to the antagonistic actuation and limits on the air pressure ranges. With this robot arm, we are able to tune control parameters using Bayesian optimization directly on the hardware without additional safety considerations. The achieved tracking performance on a fast trajectory exceeds previous results on comparable PAM-driven robots. We also show that our system can be controlled well on slow trajectories with PID controllers due to careful construction considerations such as minimal bending of cables, lightweight kinematics and minimal contact between PAMs and PAMs with the links. Finally, we propose a novel technique to control the the co-contraction of antagonistic muscle pairs. Experimental results illustrate that choosing the optimal co-contraction level is vital to reach better tracking performance. Through the use of PAM-driven robots and learning, we do a small step towards the future development of robots capable of more human-like motions.

Arxiv Video [BibTex]


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AReS and MaRS Adversarial and MMD-Minimizing Regression for SDEs

Abbati*, G., Wenk*, P., Osborne, M. A., Krause, A., Schölkopf, B., Bauer, S.

Proceedings of the 36th International Conference on Machine Learning (ICML), 97, pages: 1-10, Proceedings of Machine Learning Research, (Editors: Chaudhuri, Kamalika and Salakhutdinov, Ruslan), PMLR, 2019, *equal contribution (conference)

PDF link (url) [BibTex]

PDF link (url) [BibTex]


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Inferring causation from time series with perspectives in Earth system sciences

Runge, J., Bathiany, S., Bollt, E., Camps-Valls, G., Coumou, D., Deyle, E., Glymour, C., Kretschmer, M., Mahecha, M., van Nes, E., Peters, J., Quax, R., Reichstein, M., Scheffer, M. S. B., Spirtes, P., Sugihara, G., Sun, J., Zhang, K., Zscheischler, J.

Nature Communications, 2019 (article) In revision

[BibTex]

[BibTex]


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Kernel Stein Tests for Multiple Model Comparison

Lim, J. N., Yamada, M., Schölkopf, B., Jitkrittum, W.

2019 (conference) Submitted

[BibTex]

[BibTex]


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MYND: A Platform for Large-scale Neuroscientific Studies

Hohmann, M. R., Hackl, M., Wirth, B., Zaman, T., Enficiaud, R., Grosse-Wentrup, M., Schölkopf, B.

Proceedings of the 2019 Conference on Human Factors in Computing Systems (CHI), 2019 (conference) Accepted

[BibTex]

[BibTex]


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A Kernel Stein Test for Comparing Latent Variable Models

Kanagawa, H., Jitkrittum, W., Mackey, L., Fukumizu, K., Gretton, A.

2019 (conference) Submitted

arXiv [BibTex]

arXiv [BibTex]


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Fisher Efficient Inference of Intractable Models

Liu, S., Kanamori, T., Jitkrittum, W., Chen, Y.

2019 (conference) Submitted

arXiv [BibTex]

arXiv [BibTex]


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Fast Gaussian Process Based Gradient Matching for Parameter Identification in Systems of Nonlinear ODEs

Wenk, P., Gotovos, A., Bauer, S., Gorbach, N., Krause, A., Buhmann, J. M.

22nd International Conference on Artificial Intelligence and Statistics (AISTATS), 2019 (conference) Accepted

PDF [BibTex]

PDF [BibTex]


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From Variational to Deterministic Autoencoders

Ghosh*, P., Sajjadi*, M. S. M., Vergari, A., Black, M. J., Schölkopf, B.

2019, *equal contribution (conference) Submitted

Abstract
Variational Autoencoders (VAEs) provide a theoretically-backed framework for deep generative models. However, they often produce “blurry” images, which is linked to their training objective. Sampling in the most popular implementation, the Gaussian VAE, can be interpreted as simply injecting noise to the input of a deterministic decoder. In practice, this simply enforces a smooth latent space structure. We challenge the adoption of the full VAE framework on this specific point in favor of a simpler, deterministic one. Specifically, we investigate how substituting stochasticity with other explicit and implicit regularization schemes can lead to a meaningful latent space without having to force it to conform to an arbitrarily chosen prior. To retrieve a generative mechanism for sampling new data points, we propose to employ an efficient ex-post density estimation step that can be readily adopted both for the proposed deterministic autoencoders as well as to improve sample quality of existing VAEs. We show in a rigorous empirical study that regularized deterministic autoencoding achieves state-of-the-art sample quality on the common MNIST, CIFAR-10 and CelebA datasets.

arXiv [BibTex]

2006


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Global Biclustering of Microarray Data

Wolf, T., Brors, B., Hofmann, T., Georgii, E.

In ICDMW 2006, pages: 125-129, (Editors: Tsumoto, S. , C. W. Clifton, N. Zhong, X. Wu, J. Liu, B. W. Wah, Y.-M. Cheung), IEEE Computer Society, Los Alamitos, CA, USA, Sixth IEEE International Conference on Data Mining, December 2006 (inproceedings)

Abstract
We consider the problem of simultaneously clustering genes and conditions of a gene expression data matrix. A bicluster is defined as a subset of genes that show similar behavior within a subset of conditions. Finding biclusters can be useful for revealing groups of genes involved in the same molecular process as well as groups of conditions where this process takes place. Previous work either deals with local, bicluster-based criteria or assumes a very specific structure of the data matrix (e.g. checkerboard or block-diagonal) [11]. In contrast, our goal is to find a set of flexibly arranged biclusters which is optimal in regard to a global objective function. As this is a NP-hard combinatorial problem, we describe several techniques to obtain approximate solutions. We benchmarked our approach successfully on the Alizadeh B-cell lymphoma data set [1].

Web DOI [BibTex]

2006

Web DOI [BibTex]


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Conformal Multi-Instance Kernels

Blaschko, M., Hofmann, T.

In NIPS 2006 Workshop on Learning to Compare Examples, pages: 1-6, NIPS Workshop on Learning to Compare Examples, December 2006 (inproceedings)

Abstract
In the multiple instance learning setting, each observation is a bag of feature vectors of which one or more vectors indicates membership in a class. The primary task is to identify if any vectors in the bag indicate class membership while ignoring vectors that do not. We describe here a kernel-based technique that defines a parametric family of kernels via conformal transformations and jointly learns a discriminant function over bags together with the optimal parameter settings of the kernel. Learning a conformal transformation effectively amounts to weighting regions in the feature space according to their contribution to classification accuracy; regions that are discriminative will be weighted higher than regions that are not. This allows the classifier to focus on regions contributing to classification accuracy while ignoring regions that correspond to vectors found both in positive and in negative bags. We show how parameters of this transformation can be learned for support vector machines by posing the problem as a multiple kernel learning problem. The resulting multiple instance classifier gives competitive accuracy for several multi-instance benchmark datasets from different domains.

PDF Web [BibTex]

PDF Web [BibTex]


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Some observations on the pedestal effect or dipper function

Henning, B., Wichmann, F.

Journal of Vision, 6(13):50, 2006 Fall Vision Meeting of the Optical Society of America, December 2006 (poster)

Abstract
The pedestal effect is the large improvement in the detectabilty of a sinusoidal “signal” grating observed when the signal is added to a masking or “pedestal” grating of the same spatial frequency, orientation, and phase. We measured the pedestal effect in both broadband and notched noise - noise from which a 1.5-octave band centred on the signal frequency had been removed. Although the pedestal effect persists in broadband noise, it almost disappears in the notched noise. Furthermore, the pedestal effect is substantial when either high- or low-pass masking noise is used. We conclude that the pedestal effect in the absence of notched noise results principally from the use of information derived from channels with peak sensitivities at spatial frequencies different from that of the signal and pedestal. The spatial-frequency components of the notched noise above and below the spatial frequency of the signal and pedestal prevent the use of information about changes in contrast carried in channels tuned to spatial frequencies that are very much different from that of the signal and pedestal. Thus the pedestal or dipper effect measured without notched noise is not a characteristic of individual spatial-frequency tuned channels.

Web DOI [BibTex]

Web DOI [BibTex]


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A Kernel Method for the Two-Sample-Problem

Gretton, A., Borgwardt, K., Rasch, M., Schölkopf, B., Smola, A.

20th Annual Conference on Neural Information Processing Systems (NIPS), December 2006 (talk)

Abstract
We propose two statistical tests to determine if two samples are from different distributions. Our test statistic is in both cases the distance between the means of the two samples mapped into a reproducing kernel Hilbert space (RKHS). The first test is based on a large deviation bound for the test statistic, while the second is based on the asymptotic distribution of this statistic. We show that the test statistic can be computed in $O(m^2)$ time. We apply our approach to a variety of problems, including attribute matching for databases using the Hungarian marriage method, where our test performs strongly. We also demonstrate excellent performance when comparing distributions over graphs, for which no alternative tests currently exist.

PDF [BibTex]

PDF [BibTex]


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Ab-initio gene finding using machine learning

Schweikert, G., Zeller, G., Zien, A., Ong, C., de Bona, F., Sonnenburg, S., Phillips, P., Rätsch, G.

NIPS Workshop on New Problems and Methods in Computational Biology, December 2006 (talk)

Web [BibTex]

Web [BibTex]


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Reinforcement Learning by Reward-Weighted Regression

Peters, J.

NIPS Workshop: Towards a New Reinforcement Learning? , December 2006 (talk)

Web [BibTex]

Web [BibTex]


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Graph boosting for molecular QSAR analysis

Saigo, H., Kadowaki, T., Kudo, T., Tsuda, K.

NIPS Workshop on New Problems and Methods in Computational Biology, December 2006 (talk)

Abstract
We propose a new boosting method that systematically combines graph mining and mathematical programming-based machine learning. Informative and interpretable subgraph features are greedily found by a series of graph mining calls. Due to our mathematical programming formulation, subgraph features and pre-calculated real-valued features are seemlessly integrated. We tested our algorithm on a quantitative structure-activity relationship (QSAR) problem, which is basically a regression problem when given a set of chemical compounds. In benchmark experiments, the prediction accuracy of our method favorably compared with the best results reported on each dataset.

Web [BibTex]

Web [BibTex]


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A New Projected Quasi-Newton Approach for the Nonnegative Least Squares Problem

Kim, D., Sra, S., Dhillon, I.

(TR-06-54), Univ. of Texas, Austin, December 2006 (techreport)

PDF [BibTex]

PDF [BibTex]


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Inferring Causal Directions by Evaluating the Complexity of Conditional Distributions

Sun, X., Janzing, D., Schölkopf, B.

NIPS Workshop on Causality and Feature Selection, December 2006 (talk)

Abstract
We propose a new approach to infer the causal structure that has generated the observed statistical dependences among n random variables. The idea is that the factorization of the joint measure of cause and effect into P(cause)P(effect|cause) leads typically to simpler conditionals than non-causal factorizations. To evaluate the complexity of the conditionals we have tried two methods. First, we have compared them to those which maximize the conditional entropy subject to the observed first and second moments since we consider the latter as the simplest conditionals. Second, we have fitted the data with conditional probability measures being exponents of functions in an RKHS space and defined the complexity by a Hilbert-space semi-norm. Such a complexity measure has several properties that are useful for our purpose. We describe some encouraging results with both methods applied to real-world data. Moreover, we have combined constraint-based approaches to causal discovery (i.e., methods using only information on conditional statistical dependences) with our method in order to distinguish between causal hypotheses which are equivalent with respect to the imposed independences. Furthermore, we compare the performance to Bayesian approaches to causal inference.

Web [BibTex]


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Information-theoretic Metric Learning

Davis, J., Kulis, B., Sra, S., Dhillon, I.

In NIPS 2006 Workshop on Learning to Compare Examples, pages: 1-5, NIPS Workshop on Learning to Compare Examples, December 2006 (inproceedings)

Abstract
We formulate the metric learning problem as that of minimizing the differential relative entropy between two multivariate Gaussians under constraints on the Mahalanobis distance function. Via a surprising equivalence, we show that this problem can be solved as a low-rank kernel learning problem. Specifically, we minimize the Burg divergence of a low-rank kernel to an input kernel, subject to pairwise distance constraints. Our approach has several advantages over existing methods. First, we present a natural information-theoretic formulation for the problem. Second, the algorithm utilizes the methods developed by Kulis et al. [6], which do not involve any eigenvector computation; in particular, the running time of our method is faster than most existing techniques. Third, the formulation offers insights into connections between metric learning and kernel learning.

PDF Web [BibTex]

PDF Web [BibTex]


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Pattern Mining in Frequent Dynamic Subgraphs

Borgwardt, KM., Kriegel, H-P., Wackersreuther, P.

In pages: 818-822, (Editors: Clifton, C.W.), IEEE Computer Society, Los Alamitos, CA, USA, Sixth International Conference on Data Mining (ICDM), December 2006 (inproceedings)

Abstract
Graph-structured data is becoming increasingly abundant in many application domains. Graph mining aims at finding interesting patterns within this data that represent novel knowledge. While current data mining deals with static graphs that do not change over time, coming years will see the advent of an increasing number of time series of graphs. In this article, we investigate how pattern mining on static graphs can be extended to time series of graphs. In particular, we are considering dynamic graphs with edge insertions and edge deletions over time. We define frequency in this setting and provide algorithmic solutions for finding frequent dynamic subgraph patterns. Existing subgraph mining algorithms can be easily integrated into our framework to make them handle dynamic graphs. Experimental results on real-world data confirm the practical feasibility of our approach.

Web DOI [BibTex]

Web DOI [BibTex]


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Structure validation of the Josephin domain of ataxin-3: Conclusive evidence for an open conformation

Nicastro, G., Habeck, M., Masino, L., Svergun, DI., Pastore, A.

Journal of Biomolecular NMR, 36(4):267-277, December 2006 (article)

Abstract
The availability of new and fast tools in structure determination has led to a more than exponential growth of the number of structures solved per year. It is therefore increasingly essential to assess the accuracy of the new structures by reliable approaches able to assist validation. Here, we discuss a specific example in which the use of different complementary techniques, which include Bayesian methods and small angle scattering, resulted essential for validating the two currently available structures of the Josephin domain of ataxin-3, a protein involved in the ubiquitin/proteasome pathway and responsible for neurodegenerative spinocerebellar ataxia of type 3. Taken together, our results demonstrate that only one of the two structures is compatible with the experimental information. Based on the high precision of our refined structure, we show that Josephin contains an open cleft which could be directly implicated in the interaction with polyubiquitin chains and other partners.

Web DOI [BibTex]

Web DOI [BibTex]


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Probabilistic inference for solving (PO)MDPs

Toussaint, M., Harmeling, S., Storkey, A.

(934), School of Informatics, University of Edinburgh, December 2006 (techreport)

PDF [BibTex]

PDF [BibTex]