Multi-Task Multiple Kernel Relationship Learning

Generalization Guarantees for a Binary Classification Framework for Two-Stage Multiple Kernel Learning

We present generalization bounds for the TS-MKL framework for two stage multiple kernel learning. We also present bounds for sparse kernel learning formulations within the TS-MKL framework.

On the Relationship between Online Gaussian Process Regression and Kernel Least Mean Squares Algorithms

We study the relationship between online Gaussian process (GP) regression and kernel least mean squares (KLMS) algorithms. While the latter have no capacity of storing the entire posterior distribution during online learning, we discover that their operation corresponds to the assumption of a fixed posterior covariance that follows a simple parametric model. Interestingly, several well-known KLMS algorithms correspond to specific cases of this model. The probabilistic perspective allows us to understand how each of them handles uncertainty, which could explain some of their performance differe…

Stein Variational Gradient Descent with Multiple Kernel

Stein variational gradient descent (SVGD) and its variants have shown promising successes in approximate inference for complex distributions. In practice, we notice that the kernel used in SVGD-based methods has a decisive effect on the empirical performance. Radial basis function (RBF) kernel with median heuristics is a common choice in previous approaches, but unfortunately this has proven to be sub-optimal. Inspired by the paradigm of Multiple Kernel Learning (MKL), our solution to this flaw is using a combination of multiple kernels to approximate the optimal kernel, rather than a single o…

Deep Weisfeiler-Lehman Assignment Kernels via Multiple Kernel Learning

Kernels for structured data are commonly obtained by decomposing objects into their parts and adding up the similarities between all pairs of parts measured by a base kernel. Assignment kernels are based on an optimal bijection between the parts and have proven to be an effective alternative to the established convolution kernels. We explore how the base kernel can be learned as part of the classification problem. We build on the theory of valid assignment kernels derived from hierarchies defined on the parts. We show that the weights of this hierarchy can be optimized via multiple kernel lear…

A Unifying View of Multiple Kernel Learning

Recent research on multiple kernel learning has lead to a number of approaches for combining kernels in regularized risk minimization. The proposed approaches include different formulations of objectives and varying regularization strategies. In this paper we present a unifying general optimization criterion for multiple kernel learning and show how existing formulations are subsumed as special cases. We also derive the criterion's dual representation, which is suitable for general smooth optimization algorithms. Finally, we evaluate multiple kernel learning in this framework analytically usin…

SimpleMKKM: Simple Multiple Kernel K-means

We propose a simple yet effective multiple kernel clustering algorithm, termed simple multiple kernel k-means (SimpleMKKM). It extends the widely used supervised kernel alignment criterion to multi-kernel clustering. Our criterion is given by an intractable minimization-maximization problem in the kernel coefficient and clustering partition matrix. To optimize it, we re-formulate the problem as a smooth minimization one, which can be solved efficiently using a reduced gradient descent algorithm. We theoretically analyze the performance of SimpleMKKM in terms of its clustering generalization er…

Multiple Kernel $k$-Means Clustering by Selecting Representative Kernels

To cluster data that are not linearly separable in the original feature space, $k$-means clustering was extended to the kernel version. However, the performance of kernel $k$-means clustering largely depends on the choice of kernel function. To mitigate this problem, multiple kernel learning has been introduced into the $k$-means clustering to obtain an optimal kernel combination for clustering. Despite the success of multiple kernel $k$-means clustering in various scenarios, few of the existing work update the combination coefficients based on the diversity of kernels, which leads to the resu…

A Geometric Algorithm for Scalable Multiple Kernel Learning

We present a geometric formulation of the Multiple Kernel Learning (MKL) problem. To do so, we reinterpret the problem of learning kernel weights as searching for a kernel that maximizes the minimum (kernel) distance between two convex polytopes. This interpretation combined with novel structural insights from our geometric formulation allows us to reduce the MKL problem to a simple optimization routine that yields provable convergence as well as quality guarantees. As a result our method scales efficiently to much larger data sets than most prior methods can handle. Empirical evaluation on el…

Multiple Operator-valued Kernel Learning

Positive definite operator-valued kernels generalize the well-known notion of reproducing kernels, and are naturally adapted to multi-output learning situations. This paper addresses the problem of learning a finite linear combination of infinite-dimensional operator-valued kernels which are suitable for extending functional data analysis methods to nonlinear contexts. We study this problem in the case of kernel ridge regression for functional responses with an lr-norm constraint on the combination coefficients. The resulting optimization problem is more involved than those of multiple scalar-…

A simple yet efficient algorithm for multiple kernel learning under elastic-net constraints

This papers introduces an algorithm for the solution of multiple kernel learning (MKL) problems with elastic-net constraints on the kernel weights. The algorithm compares very favourably in terms of time and space complexity to existing approaches and can be implemented with simple code that does not rely on external libraries (except a conventional SVM solver).

$\ell_p$-Norm Multiple Kernel One-Class Fisher Null-Space

The paper addresses the multiple kernel learning (MKL) problem for one-class classification (OCC). For this purpose, based on the Fisher null-space one-class classification principle, we present a multiple kernel learning algorithm where a general $\ell_p$-norm constraint ($p\geq1$) on kernel weights is considered. We cast the proposed one-class MKL task as a min-max saddle point Lagrangian optimisation problem and propose an efficient method to solve it. An extension of the proposed one-class MKL approach is also considered where several related one-class MKL tasks are learned jointly by cons…

A Binary Classification Framework for Two-Stage Multiple Kernel Learning

With the advent of kernel methods, automating the task of specifying a suitable kernel has become increasingly important. In this context, the Multiple Kernel Learning (MKL) problem of finding a combination of pre-specified base kernels that is suitable for the task at hand has received significant attention from researchers. In this paper we show that Multiple Kernel Learning can be framed as a standard binary classification problem with additional constraints that ensure the positive definiteness of the learned kernel. Framing MKL in this way has the distinct advantage that it makes it easy …

Deep Multiple Kernel Learning

Deep learning methods have predominantly been applied to large artificial neural networks. Despite their state-of-the-art performance, these large networks typically do not generalize well to datasets with limited sample sizes. In this paper, we take a different approach by learning multiple layers of kernels. We combine kernels at each layer and then optimize over an estimate of the support vector machine leave-one-out error rather than the dual objective function. Our experiments on a variety of datasets show that each layer successively increases performance with only a few base kernels.

One-shot Distibuted Algorithm for PCA with RBF Kernels

This letter proposes a one-shot algorithm for feature-distributed kernel PCA. Our algorithm is inspired by the dual relationship between sample-distributed and feature-distributed scenario. This interesting relationship makes it possible to establish distributed kernel PCA for feature-distributed cases from ideas in distributed PCA in sample-distributed scenario. In theoretical part, we analyze the approximation error for both linear and RBF kernels. The result suggests that when eigenvalues decay fast, the proposed algorithm gives high quality results with low communication cost. This result …

Localized Multiple Kernel Learning for Anomaly Detection: One-class Classification

Multi-kernel learning has been well explored in the recent past and has exhibited promising outcomes for multi-class classification and regression tasks. In this paper, we present a multiple kernel learning approach for the One-class Classification (OCC) task and employ it for anomaly detection. Recently, the basic multi-kernel approach has been proposed to solve the OCC problem, which is simply a convex combination of different kernels with equal weights. This paper proposes a Localized Multiple Kernel learning approach for Anomaly Detection (LMKAD) using OCC, where the weight for each kernel…

多重局部线性核机器

Multiple Locally Linear Kernel Machines

该研究将多个局部线性分类器组合建模为 ℓ1 MKL 问题，并提出支持流式核的可扩展训练算法，在推理速度与分类精度之间取得平衡。

Exploring Large Feature Spaces with Hierarchical Multiple Kernel Learning

For supervised and unsupervised learning, positive definite kernels allow to use large and potentially infinite dimensional feature spaces with a computational cost that only depends on the number of observations. This is usually done through the penalization of predictor functions by Euclidean or Hilbertian norms. In this paper, we explore penalizing by sparsity-inducing norms such as the l1-norm or the block l1-norm. We assume that the kernel decomposes into a large sum of individual basis kernels which can be embedded in a directed acyclic graph; we show that it is then possible to perform …

Regularization for Multiple Kernel Learning via Sum-Product Networks

In this paper, we are interested in constructing general graph-based regularizers for multiple kernel learning (MKL) given a structure which is used to describe the way of combining basis kernels. Such structures are represented by sum-product networks (SPNs) in our method. Accordingly we propose a new convex regularization method for MLK based on a path-dependent kernel weighting function which encodes the entire SPN structure in our method. Under certain conditions and from the view of probability, this function can be considered to follow multinomial distributions over the weights associate…

Sparse Multiple Kernel Learning with Geometric Convergence Rate

In this paper, we study the problem of sparse multiple kernel learning (MKL), where the goal is to efficiently learn a combination of a fixed small number of kernels from a large pool that could lead to a kernel classifier with a small prediction error. We develop an efficient algorithm based on the greedy coordinate descent algorithm, that is able to achieve a geometric convergence rate under appropriate conditions. The convergence rate is achieved by measuring the size of functional gradients by an empirical $\ell_2$ norm that depends on the empirical data distribution. This is in contrast t…

Bayesian Efficient Multiple Kernel Learning

Multiple kernel learning algorithms are proposed to combine kernels in order to obtain a better similarity measure or to integrate feature representations coming from different data sources. Most of the previous research on such methods is focused on the computational efficiency issue. However, it is still not feasible to combine many kernels using existing Bayesian approaches due to their high time complexity. We propose a fully conjugate Bayesian formulation and derive a deterministic variational approximation, which allows us to combine hundreds or thousands of kernels very efficiently. We …

Large-Margin Multiple Kernel Learning for Discriminative Features Selection and Representation Learning

Multiple kernel learning (MKL) algorithms combine different base kernels to obtain a more efficient representation in the feature space. Focusing on discriminative tasks, MKL has been used successfully for feature selection and finding the significant modalities of the data. In such applications, each base kernel represents one dimension of the data or is derived from one specific descriptor. Therefore, MKL finds an optimal weighting scheme for the given kernels to increase the classification accuracy. Nevertheless, the majority of the works in this area focus on only binary classification pro…

Non-Sparse Regularization for Multiple Kernel Learning

Learning linear combinations of multiple kernels is an appealing strategy when the right choice of features is unknown. Previous approaches to multiple kernel learning (MKL) promote sparse kernel combinations to support interpretability and scalability. Unfortunately, this 1-norm MKL is rarely observed to outperform trivial baselines in practical applications. To allow for robust kernel mixtures, we generalize MKL to arbitrary norms. We devise new insights on the connection between several existing MKL formulations and develop two efficient interleaved optimization strategies for arbitrary nor…

A Distributionally Robust Optimization Method for Adversarial Multiple Kernel Learning

We propose a novel data-driven method to learn a mixture of multiple kernels with random features that is certifiabaly robust against adverserial inputs. Specifically, we consider a distributionally robust optimization of the kernel-target alignment with respect to the distribution of training samples over a distributional ball defined by the Kullback-Leibler (KL) divergence. The distributionally robust optimization problem can be recast as a min-max optimization whose objective function includes a log-sum term. We develop a mini-batch biased stochastic primal-dual proximal method to solve the…

Learning Hierarchical Feature Space Using CLAss-specific Subspace Multiple Kernel -- Metric Learning for Classification

Metric learning for classification has been intensively studied over the last decade. The idea is to learn a metric space induced from a normed vector space on which data from different classes are well separated. Different measures of the separation thus lead to various designs of the objective function in the metric learning model. One classical metric is the Mahalanobis distance, where a linear transformation matrix is designed and applied on the original dataset to obtain a new subspace equipped with the Euclidean norm. The kernelized version has also been developed, followed by Multiple-K…

Online Learning with Multiple Operator-valued Kernels

We consider the problem of learning a vector-valued function f in an online learning setting. The function f is assumed to lie in a reproducing Hilbert space of operator-valued kernels. We describe two online algorithms for learning f while taking into account the output structure. A first contribution is an algorithm, ONORMA, that extends the standard kernel-based online learning algorithm NORMA from scalar-valued to operator-valued setting. We report a cumulative error bound that holds both for classification and regression. We then define a second algorithm, MONORMA, which addresses the lim…

Learning the kernel matrix via predictive low-rank approximations

Efficient and accurate low-rank approximations of multiple data sources are essential in the era of big data. The scaling of kernel-based learning algorithms to large datasets is limited by the O(n^2) computation and storage complexity of the full kernel matrix, which is required by most of the recent kernel learning algorithms. We present the Mklaren algorithm to approximate multiple kernel matrices learn a regression model, which is entirely based on geometrical concepts. The algorithm does not require access to full kernel matrices yet it accounts for the correlations between all kernels. I…

Nonlinear Causal Discovery via Kernel Anchor Regression

Learning causal relationships is a fundamental problem in science. Anchor regression has been developed to address this problem for a large class of causal graphical models, though the relationships between the variables are assumed to be linear. In this work, we tackle the nonlinear setting by proposing kernel anchor regression (KAR). Beyond the natural formulation using a classic two-stage least square estimator, we also study an improved variant that involves nonparametric regression in three separate stages. We provide convergence results for the proposed KAR estimators and the identifiabi…

Spectral Mixture Kernels for Multi-Output Gaussian Processes

Early approaches to multiple-output Gaussian processes (MOGPs) relied on linear combinations of independent, latent, single-output Gaussian processes (GPs). This resulted in cross-covariance functions with limited parametric interpretation, thus conflicting with the ability of single-output GPs to understand lengthscales, frequencies and magnitudes to name a few. On the contrary, current approaches to MOGP are able to better interpret the relationship between different channels by directly modelling the cross-covariances as a spectral mixture kernel with a phase shift. We extend this rationale…

Analogy-Based Preference Learning with Kernels

Building on a specific formalization of analogical relationships of the form "A relates to B as C relates to D", we establish a connection between two important subfields of artificial intelligence, namely analogical reasoning and kernel-based machine learning. More specifically, we show that so-called analogical proportions are closely connected to kernel functions on pairs of objects. Based on this result, we introduce the analogy kernel, which can be seen as a measure of how strongly four objects are in analogical relationship. As an application, we consider the problem of object ranking in…

Efficient Output Kernel Learning for Multiple Tasks

The paradigm of multi-task learning is that one can achieve better generalization by learning tasks jointly and thus exploiting the similarity between the tasks rather than learning them independently of each other. While previously the relationship between tasks had to be user-defined in the form of an output kernel, recent approaches jointly learn the tasks and the output kernel. As the output kernel is a positive semidefinite matrix, the resulting optimization problems are not scalable in the number of tasks as an eigendecomposition is required in each step. \mbox{Using} the theory of posit…

A Randomized Mirror Descent Algorithm for Large Scale Multiple Kernel Learning

We consider the problem of simultaneously learning to linearly combine a very large number of kernels and learn a good predictor based on the learnt kernel. When the number of kernels $d$ to be combined is very large, multiple kernel learning methods whose computational cost scales linearly in $d$ are intractable. We propose a randomized version of the mirror descent algorithm to overcome this issue, under the objective of minimizing the group $p$-norm penalized empirical risk. The key to achieve the required exponential speed-up is the computationally efficient construction of low-variance es…

Multi-Task Kernel Null-Space for One-Class Classification

The one-class kernel spectral regression (OC-KSR), the regression-based formulation of the kernel null-space approach has been found to be an effective Fisher criterion-based methodology for one-class classification (OCC), achieving state-of-the-art performance in one-class classification while providing relatively high robustness against data corruption. This work extends the OC-KSR methodology to a multi-task setting where multiple one-class problems share information for improved performance. By viewing the multi-task structure learning problem as one of compositional function learning, fir…

On the relationship between multitask neural networks and multitask Gaussian Processes

Despite the effectiveness of multitask deep neural network (MTDNN), there is a limited theoretical understanding on how the information is shared across different tasks in MTDNN. In this work, we establish a formal connection between MTDNN with infinitely-wide hidden layers and multitask Gaussian Process (GP). We derive multitask GP kernels corresponding to both single-layer and deep multitask Bayesian neural networks (MTBNN) and show that information among different tasks is shared primarily due to correlation across last layer weights of MTBNN and shared hyper-parameters, which is contrary t…

Multi-view Kernel Completion

In this paper, we introduce the first method that (1) can complete kernel matrices with completely missing rows and columns as opposed to individual missing kernel values, (2) does not require any of the kernels to be complete a priori, and (3) can tackle non-linear kernels. These aspects are necessary in practical applications such as integrating legacy data sets, learning under sensor failures and learning when measurements are costly for some of the views. The proposed approach predicts missing rows by modelling both within-view and between-view relationships among kernel values. We show, b…

Identifying Outliers using Influence Function of Multiple Kernel Canonical Correlation Analysis

Imaging genetic research has essentially focused on discovering unique and co-association effects, but typically ignoring to identify outliers or atypical objects in genetic as well as non-genetics variables. Identifying significant outliers is an essential and challenging issue for imaging genetics and multiple sources data analysis. Therefore, we need to examine for transcription errors of identified outliers. First, we address the influence function (IF) of kernel mean element, kernel covariance operator, kernel cross-covariance operator, kernel canonical correlation analysis (kernel CCA) a…

Stochastic Learning of Nonstationary Kernels for Natural Language Modeling

Natural language processing often involves computations with semantic or syntactic graphs to facilitate sophisticated reasoning based on structural relationships. While convolution kernels provide a powerful tool for comparing graph structure based on node (word) level relationships, they are difficult to customize and can be computationally expensive. We propose a generalization of convolution kernels, with a nonstationary model, for better expressibility of natural languages in supervised settings. For a scalable learning of the parameters introduced with our model, we propose a novel algori…

Learning Schizophrenia Imaging Genetics Data Via Multiple Kernel Canonical Correlation Analysis

Kernel and Multiple Kernel Canonical Correlation Analysis (CCA) are employed to classify schizophrenic and healthy patients based on their SNPs, DNA Methylation and fMRI data. Kernel and Multiple Kernel CCA are popular methods for finding nonlinear correlations between high-dimensional datasets. Data was gathered from 183 patients, 79 with schizophrenia and 104 healthy controls. Kernel and Multiple Kernel CCA represent new avenues for studying schizophrenia, because, to our knowledge, these methods have not been used on these data before. Classification is performed via k-means clustering on t…

用于多组学数据整合的监督式多核学习方法

Supervised Multiple Kernel Learning approaches for multi-omics data integration

本文提出基于多种核融合策略的监督式MKL方法，并结合支持向量机与深度学习架构，证明其在多组学整合预测中可优于复杂的先进方法。

Kernel Instrumental Variable Regression

Instrumental variable (IV) regression is a strategy for learning causal relationships in observational data. If measurements of input X and output Y are confounded, the causal relationship can nonetheless be identified if an instrumental variable Z is available that influences X directly, but is conditionally independent of Y given X and the unmeasured confounder. The classic two-stage least squares algorithm (2SLS) simplifies the estimation problem by modeling all relationships as linear functions. We propose kernel instrumental variable regression (KIV), a nonparametric generalization of 2SL…

Multiple Kernel Learning: A Unifying Probabilistic Viewpoint

We present a probabilistic viewpoint to multiple kernel learning unifying well-known regularised risk approaches and recent advances in approximate Bayesian inference relaxations. The framework proposes a general objective function suitable for regression, robust regression and classification that is lower bound of the marginal likelihood and contains many regularised risk approaches as special cases. Furthermore, we derive an efficient and provably convergent optimisation algorithm.

The Local Rademacher Complexity of Lp-Norm Multiple Kernel Learning

We derive an upper bound on the local Rademacher complexity of $\ell_p$-norm multiple kernel learning, which yields a tighter excess risk bound than global approaches. Previous local approaches aimed at analyzed the case $p=1$ only while our analysis covers all cases $1\leq p\leq\infty$, assuming the different feature mappings corresponding to the different kernels to be uncorrelated. We also show a lower bound that shows that the bound is tight, and derive consequences regarding excess loss, namely fast convergence rates of the order $O(n^{-\fracα{1+α}})$, where $α$ is the minimum eigenvalue …

LMKL-Net: A Fast Localized Multiple Kernel Learning Solver via Deep Neural Networks

In this paper we propose solving localized multiple kernel learning (LMKL) using LMKL-Net, a feedforward deep neural network. In contrast to previous works, as a learning principle we propose {\em parameterizing} both the gating function for learning kernel combination weights and the multiclass classifier in LMKL using an attentional network (AN) and a multilayer perceptron (MLP), respectively. In this way we can learn the (nonlinear) decision function in LMKL (approximately) by sequential applications of AN and MLP. Empirically on benchmark datasets we demonstrate that overall LMKL-Net can n…

Multiple Kernel Learning and Automatic Subspace Relevance Determination for High-dimensional Neuroimaging Data

Alzheimer's disease is a major cause of dementia. Its diagnosis requires accurate biomarkers that are sensitive to disease stages. In this respect, we regard probabilistic classification as a method of designing a probabilistic biomarker for disease staging. Probabilistic biomarkers naturally support the interpretation of decisions and evaluation of uncertainty associated with them. In this paper, we obtain probabilistic biomarkers via Gaussian Processes. Gaussian Processes enable probabilistic kernel machines that offer flexible means to accomplish Multiple Kernel Learning. Exploiting this fl…

Learning Non-overlapping Convolutional Neural Networks with Multiple Kernels

In this paper, we consider parameter recovery for non-overlapping convolutional neural networks (CNNs) with multiple kernels. We show that when the inputs follow Gaussian distribution and the sample size is sufficiently large, the squared loss of such CNNs is $\mathit{~locally~strongly~convex}$ in a basin of attraction near the global optima for most popular activation functions, like ReLU, Leaky ReLU, Squared ReLU, Sigmoid and Tanh. The required sample complexity is proportional to the dimension of the input and polynomial in the number of kernels and a condition number of the parameters. We …

Active Learning with Multiple Kernels

Online multiple kernel learning (OMKL) has provided an attractive performance in nonlinear function learning tasks. Leveraging a random feature approximation, the major drawback of OMKL, known as the curse of dimensionality, has been recently alleviated. In this paper, we introduce a new research problem, termed (stream-based) active multiple kernel learning (AMKL), in which a learner is allowed to label selected data from an oracle according to a selection criterion. This is necessary in many real-world applications as acquiring true labels is costly or time-consuming. We prove that AMKL achi…

Fast Convergence Rate of Multiple Kernel Learning with Elastic-net Regularization

We investigate the learning rate of multiple kernel leaning (MKL) with elastic-net regularization, which consists of an $\ell_1$-regularizer for inducing the sparsity and an $\ell_2$-regularizer for controlling the smoothness. We focus on a sparse setting where the total number of kernels is large but the number of non-zero components of the ground truth is relatively small, and prove that elastic-net MKL achieves the minimax learning rate on the $\ell_2$-mixed-norm ball. Our bound is sharper than the convergence rates ever shown, and has a property that the smoother the truth is, the faster t…

Online Multiple Kernel Learning for Structured Prediction

Despite the recent progress towards efficient multiple kernel learning (MKL), the structured output case remains an open research front. Current approaches involve repeatedly solving a batch learning problem, which makes them inadequate for large scale scenarios. We propose a new family of online proximal algorithms for MKL (as well as for group-lasso and variants thereof), which overcomes that drawback. We show regret, convergence, and generalization bounds for the proposed method. Experiments on handwriting recognition and dependency parsing testify for the successfulness of the approach.

Adaptive Graph via Multiple Kernel Learning for Nonnegative Matrix Factorization

Nonnegative Matrix Factorization (NMF) has been continuously evolving in several areas like pattern recognition and information retrieval methods. It factorizes a matrix into a product of 2 low-rank non-negative matrices that will define parts-based, and linear representation of nonnegative data. Recently, Graph regularized NMF (GrNMF) is proposed to find a compact representation,which uncovers the hidden semantics and simultaneously respects the intrinsic geometric structure. In GNMF, an affinity graph is constructed from the original data space to encode the geometrical information. In this …

Variational Inducing Kernels for Sparse Convolved Multiple Output Gaussian Processes

Interest in multioutput kernel methods is increasing, whether under the guise of multitask learning, multisensor networks or structured output data. From the Gaussian process perspective a multioutput Mercer kernel is a covariance function over correlated output functions. One way of constructing such kernels is based on convolution processes (CP). A key problem for this approach is efficient inference. Alvarez and Lawrence (2009) recently presented a sparse approximation for CPs that enabled efficient inference. In this paper, we extend this work in two directions: we introduce the concept of…

Sharp Convergence Rate and Support Consistency of Multiple Kernel Learning with Sparse and Dense Regularization

We theoretically investigate the convergence rate and support consistency (i.e., correctly identifying the subset of non-zero coefficients in the large sample limit) of multiple kernel learning (MKL). We focus on MKL with block-l1 regularization (inducing sparse kernel combination), block-l2 regularization (inducing uniform kernel combination), and elastic-net regularization (including both block-l1 and block-l2 regularization). For the case where the true kernel combination is sparse, we show a sharper convergence rate of the block-l1 and elastic-net MKL methods than the existing rate for blo…

Constrained Clustering and Multiple Kernel Learning without Pairwise Constraint Relaxation

Clustering under pairwise constraints is an important knowledge discovery tool that enables the learning of appropriate kernels or distance metrics to improve clustering performance. These pairwise constraints, which come in the form of must-link and cannot-link pairs, arise naturally in many applications and are intuitive for users to provide. However, the common practice of relaxing discrete constraints to a continuous domain to ease optimization when learning kernels or metrics can harm generalization, as information which only encodes linkage is transformed to informing distances. We intro…

On the Multiple Descent of Minimum-Norm Interpolants and Restricted Lower Isometry of Kernels

We study the risk of minimum-norm interpolants of data in Reproducing Kernel Hilbert Spaces. Our upper bounds on the risk are of a multiple-descent shape for the various scalings of $d = n^α$, $α\in(0,1)$, for the input dimension $d$ and sample size $n$. Empirical evidence supports our finding that minimum-norm interpolants in RKHS can exhibit this unusual non-monotonicity in sample size; furthermore, locations of the peaks in our experiments match our theoretical predictions. Since gradient flow on appropriately initialized wide neural networks converges to a minimum-norm interpolant with res…

用于学习多输入多输出算子的核方法

Kernel Methods for Learning Operators with Multiple Inputs and Outputs

针对科学机器学习中无限维对象映射学习难题，提出基于核的编码器-解码器框架，开发KernelMO核方法，在五类参数化偏微分方程上实现高精度且高效的算子学习，性能优于相关深度学习模型。

PIMKL: Pathway Induced Multiple Kernel Learning

Reliable identification of molecular biomarkers is essential for accurate patient stratification. While state-of-the-art machine learning approaches for sample classification continue to push boundaries in terms of performance, most of these methods are not able to integrate different data types and lack generalization power, limiting their application in a clinical setting. Furthermore, many methods behave as black boxes, and we have very little understanding about the mechanisms that lead to the prediction. While opaqueness concerning machine behaviour might not be a problem in deterministic…