A new clustering accuracy measure is proposed to determine the unknown number of clusters and to assess the quality of clustering of a data set given in any dimensional space. Our validity index applies the classical nonparametric univariate kernel density estimation method to the interpoint distances computed between the members of data. Being based on interpoint distances, it is free of the curse of dimensionality and therefore efficiently computable for high-dimensional situations where the number of study variables can be larger than the sample size. The proposed measure is compatible with any clustering algorithm and with every kind of data set where the interpoint distance measure can be defined to have a density function. Simulation study proves its superiority over widely used cluster validity indices like the average silhouette width and the Dunn index, whereas its applicability is shown with respect to a high-dimensional Biostatistical study of Alon data set and a large Astrostatistical application of time series with light curves of new variable stars.
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Truncated densities are probability density functions defined on truncated domains. They share the same parametric form with their non-truncated counterparts up to a normalizing constant. Since the computation of their normalizing constants is usually infeasible, Maximum Likelihood Estimation cannot be easily applied to estimate truncated density models. Score Matching (SM) is a powerful tool for fitting parameters using only unnormalized models. However, it cannot be directly applied here as boundary conditions used to derive a tractable SM objective are not satisfied by truncated densities. In this paper, we study parameter estimation for truncated probability densities using SM. The estimator minimizes a weighted Fisher divergence. The weight function is simply the shortest distance from a data point to the boundary of the domain. We show this choice of weight function naturally arises from minimizing the Stein discrepancy as well as upperbounding the finite-sample estimation error. The usefulness of our method is demonstrated by numerical experiments and a study on the Chicago crime data set. We also show that the proposed density estimation can correct the outlier-trimming bias caused by aggressive outlier detection methods.
Differential privacy is a mathematical concept that provides an information-theoretic security guarantee. While differential privacy has emerged as a de facto standard for guaranteeing privacy in data sharing, the known mechanisms to achieve it come with some serious limitations. Utility guarantees are usually provided only for a fixed, a priori specified set of queries. Moreover, there are no utility guarantees for more complex - but very common - machine learning tasks such as clustering or classification. In this paper we overcome some of these limitations. Working with metric privacy, a powerful generalization of differential privacy, we develop a polynomial-time algorithm that creates a private measure from a data set. This private measure allows us to efficiently construct private synthetic data that are accurate for a wide range of statistical analysis tools. Moreover, we prove an asymptotically sharp min-max result for private measures and synthetic data for general compact metric spaces. A key ingredient in our construction is a new superregular random walk, whose joint distribution of steps is as regular as that of independent random variables, yet which deviates from the origin logarithmicaly slowly.
Continuous-time measurements are instrumental for a multitude of tasks in quantum engineering and quantum control, including the estimation of dynamical parameters of open quantum systems monitored through the environment. However, such measurements do not extract the maximum amount of information available in the output state, so finding alternative optimal measurement strategies is a major open problem. In this paper we solve this problem in the setting of discrete-time input-output quantum Markov chains. We present an efficient algorithm for optimal estimation of one-dimensional dynamical parameters which consists of an iterative procedure for updating a `measurement filter' operator and determining successive measurement bases for the output units. A key ingredient of the scheme is the use of a coherent quantum absorber as a way to post-process the output after the interaction with the system. This is designed adaptively such that the joint system and absorber stationary state is pure at a reference parameter value. The scheme offers an exciting prospect for optimal continuous-time adaptive measurements, but more work is needed to find realistic practical implementations.
Laser-induced breakdown spectroscopy is a preferred technique for fast and direct multi-elemental mapping of samples under ambient pressure, without any limitation on the targeted element. However, LIBS mapping data have two peculiarities: an intrinsically low signal-to-noise ratio due to single-shot measurements, and a high dimensionality due to the high number of spectra acquired for imaging. This is all the truer as lateral resolution gets higher: in this case, the ablation spot diameter is reduced, as well as the ablated mass and the emission signal, while the number of spectra for a given surface increases. Therefore, efficient extraction of physico-chemical information from a noisy and large dataset is a major issue. Multivariate approaches were introduced by several authors as a means to cope with such data, particularly Principal Component Analysis. Yet, PCA is known to present theoretical constraints for the consistent reconstruction of the dataset, and has therefore limitations to efficient interpretation of LIBS mapping data. In this paper, we introduce HyperPCA, a new analysis tool for hyperspectral images based on a sparse representation of the data using Discrete Wavelet Transform and kernel-based sparse PCA to reduce the impact of noise on the data and to consistently reconstruct the spectroscopic signal, with a particular emphasis on LIBS data. The method is first illustrated using simulated LIBS mapping datasets to emphasize its performances with highly noisy and/or highly interfered spectra. Comparisons to standard PCA and to traditional univariate data analyses are provided. Finally, it is used to process real data in two cases that clearly illustrate the potential of the proposed algorithm. We show that the method presents advantages both in quantity and quality of the information recovered, thus improving the physico-chemical characterisation of analysed surfaces.
Covariance estimation for matrix-valued data has received an increasing interest in applications. Unlike previous works that rely heavily on matrix normal distribution assumption and the requirement of fixed matrix size, we propose a class of distribution-free regularized covariance estimation methods for high-dimensional matrix data under a separability condition and a bandable covariance structure. Under these conditions, the original covariance matrix is decomposed into a Kronecker product of two bandable small covariance matrices representing the variability over row and column directions. We formulate a unified framework for estimating bandable covariance, and introduce an efficient algorithm based on rank one unconstrained Kronecker product approximation. The convergence rates of the proposed estimators are established, and the derived minimax lower bound shows our proposed estimator is rate-optimal under certain divergence regimes of matrix size. We further introduce a class of robust covariance estimators and provide theoretical guarantees to deal with heavy-tailed data. We demonstrate the superior finite-sample performance of our methods using simulations and real applications from a gridded temperature anomalies dataset and a S&P 500 stock data analysis.
How to recover a probability measure with sparse support from particular moments? This problem has been the focus of research in theoretical computer science and neural computing. However, there is no polynomial-time algorithm for the recovery. The best algorithm for the recovery requires $O(2^{\text{poly}(1/\epsilon)})$ for $\epsilon$-accurate recovery. We propose the first poly-time recovery method from carefully designed moments that only requires $O(\log(1/\epsilon)/\epsilon^2)$ computations for an $\epsilon$-accurate recovery. This method relies on the recovery of a planted two-layer neural network with two-dimensional inputs, a finite width, and zero-one activation. For such networks, we establish the first global convergence of gradient descent and demonstrate its application in sparse measure recovery.
Low-rank matrix estimation under heavy-tailed noise is challenging, both computationally and statistically. Convex approaches have been proven statistically optimal but suffer from high computational costs, especially since robust loss functions are usually non-smooth. More recently, computationally fast non-convex approaches via sub-gradient descent are proposed, which, unfortunately, fail to deliver a statistically consistent estimator even under sub-Gaussian noise. In this paper, we introduce a novel Riemannian sub-gradient (RsGrad) algorithm which is not only computationally efficient with linear convergence but also is statistically optimal, be the noise Gaussian or heavy-tailed. Convergence theory is established for a general framework and specific applications to absolute loss, Huber loss, and quantile loss are investigated. Compared with existing non-convex methods, ours reveals a surprising phenomenon of dual-phase convergence. In phase one, RsGrad behaves as in a typical non-smooth optimization that requires gradually decaying stepsizes. However, phase one only delivers a statistically sub-optimal estimator which is already observed in the existing literature. Interestingly, during phase two, RsGrad converges linearly as if minimizing a smooth and strongly convex objective function and thus a constant stepsize suffices. Underlying the phase-two convergence is the smoothing effect of random noise to the non-smooth robust losses in an area close but not too close to the truth. Lastly, RsGrad is applicable for low-rank tensor estimation under heavy-tailed noise where a statistically optimal rate is attainable with the same phenomenon of dual-phase convergence, and a novel shrinkage-based second-order moment method is guaranteed to deliver a warm initialization. Numerical simulations confirm our theoretical discovery and showcase the superiority of RsGrad over prior methods.
In this paper we study the finite sample and asymptotic properties of various weighting estimators of the local average treatment effect (LATE), several of which are based on Abadie (2003)'s kappa theorem. Our framework presumes a binary endogenous explanatory variable ("treatment") and a binary instrumental variable, which may only be valid after conditioning on additional covariates. We argue that one of the Abadie estimators, which we show is weight normalized, is likely to dominate the others in many contexts. A notable exception is in settings with one-sided noncompliance, where certain unnormalized estimators have the advantage of being based on a denominator that is bounded away from zero. We use a simulation study and three empirical applications to illustrate our findings. In applications to causal effects of college education using the college proximity instrument (Card, 1995) and causal effects of childbearing using the sibling sex composition instrument (Angrist and Evans, 1998), the unnormalized estimates are clearly unreasonable, with "incorrect" signs, magnitudes, or both. Overall, our results suggest that (i) the relative performance of different kappa weighting estimators varies with features of the data-generating process; and that (ii) the normalized version of Tan (2006)'s estimator may be an attractive alternative in many contexts. Applied researchers with access to a binary instrumental variable should also consider covariate balancing or doubly robust estimators of the LATE.
The performance of a quantum information processing protocol is ultimately judged by distinguishability measures that quantify how distinguishable the actual result of the protocol is from the ideal case. The most prominent distinguishability measures are those based on the fidelity and trace distance, due to their physical interpretations. In this paper, we propose and review several algorithms for estimating distinguishability measures based on trace distance and fidelity. The algorithms can be used for distinguishing quantum states, channels, and strategies (the last also known in the literature as "quantum combs"). The fidelity-based algorithms offer novel physical interpretations of these distinguishability measures in terms of the maximum probability with which a single prover (or competing provers) can convince a verifier to accept the outcome of an associated computation. We simulate many of these algorithms by using a variational approach with parameterized quantum circuits. We find that the simulations converge well in both the noiseless and noisy scenarios, for all examples considered. Furthermore, the noisy simulations exhibit a parameter noise resilience.
We present a new sublinear time algorithm for approximating the spectral density (eigenvalue distribution) of an $n\times n$ normalized graph adjacency or Laplacian matrix. The algorithm recovers the spectrum up to $\epsilon$ accuracy in the Wasserstein-1 distance in $O(n\cdot \text{poly}(1/\epsilon))$ time given sample access to the graph. This result compliments recent work by David Cohen-Steiner, Weihao Kong, Christian Sohler, and Gregory Valiant (2018), which obtains a solution with runtime independent of $n$, but exponential in $1/\epsilon$. We conjecture that the trade-off between dimension dependence and accuracy is inherent. Our method is simple and works well experimentally. It is based on a Chebyshev polynomial moment matching method that employees randomized estimators for the matrix trace. We prove that, for any Hermitian $A$, this moment matching method returns an $\epsilon$ approximation to the spectral density using just $O({1}/{\epsilon})$ matrix-vector products with $A$. By leveraging stability properties of the Chebyshev polynomial three-term recurrence, we then prove that the method is amenable to the use of coarse approximate matrix-vector products. Our sublinear time algorithm follows from combining this result with a novel sampling algorithm for approximating matrix-vector products with a normalized graph adjacency matrix. Of independent interest, we show a similar result for the widely used \emph{kernel polynomial method} (KPM), proving that this practical algorithm nearly matches the theoretical guarantees of our moment matching method. Our analysis uses tools from Jackson's seminal work on approximation with positive polynomial kernels.
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