Enhancing Compressed Sensing 4D Photoacoustic Tomography by Simultaneous Motion Estimation

A crucial limitation of current high-resolution 3D photoacoustic tomography (PAT) devices that employ sequential scanning is their long acquisition time. In previous work, we demonstrated how to use compressed sensing techniques to improve upon this: images with good spatial resolution and contrast can be obtained from suitably sub-sampled PAT data acquired by novel acoustic scanning systems if sparsity-constrained image reconstruction techniques such as total variation regularization are used. Now, we show how a further increase of image quality can be achieved for imaging dynamic processes in living tissue (4D PAT). The key idea is to exploit the additional temporal redundancy of the data by coupling the previously used spatial image reconstruction models with sparsity-constrained motion estimation models. While simulated data from a two-dimensional numerical phantom will be used to illustrate the main properties of this recently developed joint-image-reconstruction-and-motion-estimation framework, measured data from a dynamic experimental phantom will also be used to demonstrate their potential for challenging, large-scale, real-world, three-dimensional scenarios. The latter only becomes feasible if a carefully designed combination of tailored optimization schemes is employed, which we describe and examine in more detail

Fast Numerical and Machine Learning Algorithms for Spatial Audio Reproduction

Audio reproduction technologies have underwent several revolutions from a purely mechanical, to electromagnetic, and into a digital process. These changes have resulted in steady improvements in the objective qualities of sound capture/playback on increasingly portable devices. However, most mobile playback devices remove important spatial-directional components of externalized sound which are natural to the subjective experience of human hearing. Fortunately, the missing spatial-directional parts can be integrated back into audio through a combination of computational methods and physical knowledge of how sound scatters off of the listener's anthropometry in the sound-field. The former employs signal processing techniques for rendering the sound-field. The latter employs approximations of the sound-field through the measurement of so-called Head-Related Impulse Responses/Transfer Functions (HRIRs/HRTFs). This dissertation develops several numerical and machine learning algorithms for accelerating and personalizing spatial audio reproduction in light of available mobile computing power. First, spatial audio synthesis between a sound-source and sound-field requires fast convolution algorithms between the audio-stream and the HRIRs. We introduce a novel sparse decomposition algorithm for HRIRs based on non-negative matrix factorization that allows for faster time-domain convolution than frequency-domain fast-Fourier-transform variants. Second, the full sound-field over the spherical coordinate domain must be efficiently approximated from a finite collection of HRTFs. We develop a joint spatial-frequency covariance model for Gaussian process regression (GPR) and sparse-GPR methods that supports the fast interpolation and data fusion of HRTFs across multiple data-sets. Third, the direct measurement of HRTFs requires specialized equipment that is unsuited for widespread acquisition. We ``bootstrap'' the human ability to localize sound in listening tests with Gaussian process active-learning techniques over graphical user interfaces that allows the listener to infer his/her own HRTFs. Experiments are conducted on publicly available HRTF datasets and human listeners

Computational Methods for Matrix/Tensor Factorization and Deep Learning Image Denoising

Feature learning is a technique to automatically extract features from raw data. It is widely used in areas such as computer vision, image processing, data mining and natural language processing. In this thesis, we are interested in the computational aspects of feature learning. We focus on rank matrix and tensor factorization and deep neural network models for image denoising. With respect to matrix and tensor factorization, we first present a technique to speed up alternating least squares (ALS) and gradient descent (GD) − two commonly used strategies for tensor factorization. We introduce an efficient, scalable and distributed algorithm that addresses the data explosion problem. Instead of a computationally challenging sub-step of ALS and GD, we implement the algorithm on parallel machines by using only two sparse matrix-vector products. Not only is the algorithm scalable but it is also on average 4 to 10 times faster than competing algorithms on various data sets. Next, we discuss our results of non-negative matrix factorization for hyperspectral image data in the presence of noise. We introduce a spectral total variation regularization and derive four variants of the alternating direction method of multiplier algorithm. While all four methods belong to the same family of algorithms, some perform better than others. Thus, we compare the algorithms using stimulated Raman spectroscopic image will be demonstrated. For deep neural network models, we focus on its application to image denoising. We first demonstrate how an optimal procedure leveraging deep neural networks and convex optimization can combine a given set of denoisers to produce an overall better result. The proposed framework estimates the mean squared error (MSE) of individual denoised outputs using a deep neural network; optimally combines the denoised outputs via convex optimization; and recovers lost details of the combined images using another deep neural network. The framework consistently improves denoising performance for both deterministic denoisers and neural network denoisers. Next, we apply the deep neural network to solve the image reconstruction issues of the Quanta Image Sensor (QIS), which is a single-photon image sensor that oversamples the light field to generate binary measures

병렬화 용이한 통계계산 방법론과 현대 고성능 컴퓨팅 환경에의 적용

학위논문 (박사) -- 서울대학교 대학원 : 자연과학대학 통계학과, 2020. 8. 원중호.Technological advances in the past decade, hardware and software alike, have made access to high-performance computing (HPC) easier than ever. In this dissertation, easily-parallelizable, inversion-free, and variable-separated algorithms and their implementation in statistical computing are discussed. The first part considers statistical estimation problems under structured sparsity posed as minimization of a sum of two or three convex functions, one of which is a composition of non-smooth and linear functions. Examples include graph-guided sparse fused lasso and overlapping group lasso. Two classes of inversion-free primal-dual algorithms are considered and unified from a perspective of monotone operator theory. From this unification, a continuum of preconditioned forward-backward operator splitting algorithms amenable to parallel and distributed computing is proposed. The unification is further exploited to introduce a continuum of accelerated algorithms on which the theoretically optimal asymptotic rate of convergence is obtained. For the second part, easy-to-use distributed matrix data structures in PyTorch and Julia are presented. They enable users to write code once and run it anywhere from a laptop to a workstation with multiple graphics processing units (GPUs) or a supercomputer in a cloud. With these data structures, various parallelizable statistical applications, including nonnegative matrix factorization, positron emission tomography, multidimensional scaling, and ℓ1-regularized Cox regression, are demonstrated. The examples scale up to an 8-GPU workstation and a 720-CPU-core cluster in a cloud. As a case in point, the onset of type-2 diabetes from the UK Biobank with 400,000 subjects and about 500,000 single nucleotide polymorphisms is analyzed using the HPC ℓ1-regularized Cox regression. Fitting a half-million variate model took about 50 minutes, reconfirming known associations. To my knowledge, the feasibility of a joint genome-wide association analysis of survival outcomes at this scale is first demonstrated.지난 10년간의 하드웨어와 소프트웨어의 기술적인 발전은 고성능 컴퓨팅의 접근장벽을 그 어느 때보다 낮추었다. 이 학위논문에서는 병렬화 용이하고 역행렬 연산이 없는 변수 분리 알고리즘과 그 통계계산에서의 구현을 논의한다. 첫 부분은 볼록 함수 두 개 또는 세 개의 합으로 나타나는 구조화된 희소 통계 추정 문제에 대해 다룬다. 이 때 함수들 중 하나는 비평활 함수와 선형 함수의 합성으로 나타난다. 그 예시로는 그래프 구조를 통해 유도되는 희소 융합 Lasso 문제와 한 변수가 여러 그룹에 속할 수 있는 그룹 Lasso 문제가 있다. 이를 풀기 위해 역행렬 연산이 없는 두 종류의 원시-쌍대 (primal-dual) 알고리즘을 단조 연산자 이론 관점에서 통합하며 이를 통해 병렬화 용이한 precondition된 전방-후방 연산자 분할 알고리즘의 집합을 제안한다. 이 통합은 점근적으로 최적 수렴률을 갖는 가속 알고리즘의 집합을 구성하는 데 활용된다. 두 번째 부분에서는 PyTorch와 Julia를 통해 사용하기 쉬운 분산 행렬 자료 구조를 제시한다. 이 구조는 사용자들이 코드를 한 번 작성하면 이것을 노트북 한 대에서부터 여러 대의 그래픽 처리 장치 (GPU)를 가진 워크스테이션, 또는 클라우드 상에 있는 슈퍼컴퓨터까지 다양한 스케일에서 실행할 수 있게 해 준다. 아울러, 이 자료 구조를 비음 행렬 분해, 양전자 단층 촬영, 다차원 척 도법, ℓ1-벌점화 Cox 회귀 분석 등 다양한 병렬화 가능한 통계적 문제에 적용한다. 이 예시들은 8대의 GPU가 있는 워크스테이션과 720개의 코어가 있는 클라우드 상의 가상 클러스터에서 확장 가능했다. 한 사례로 400,000명의 대상과 500,000개의 단일 염기 다형성 정보가 있는 UK Biobank 자료에서의 제2형 당뇨병 (T2D) 발병 나이를 ℓ1-벌점화 Cox 회귀 모형을 통해 분석했다. 500,000개의 변수가 있는 모형을 적합시키는 데 50분 가량의 시간이 걸렸으며 알려진 T2D 관련 다형성들을 재확인할 수 있었다. 이러한 규모의 전유전체 결합 생존 분석은 최초로 시도된 것이다.Chapter1Prologue 1 1.1 Introduction 1 1.2 Accessible High-Performance Computing Systems 4 1.2.1 Preliminaries 4 1.2.2 Multiple CPU nodes: clusters, supercomputers, and clouds 7 1.2.3 Multi-GPU node 9 1.3 Highly Parallelizable Algorithms 12 1.3.1 MM algorithms 12 1.3.2 Proximal gradient descent 14 1.3.3 Proximal distance algorithm 16 1.3.4 Primal-dual methods 17 Chapter 2 Easily Parallelizable and Distributable Class of Algorithms for Structured Sparsity, with Optimal Acceleration 20 2.1 Introduction 20 2.2 Unification of Algorithms LV and CV (g ≡ 0) 30 2.2.1 Relation between Algorithms LV and CV 30 2.2.2 Unified algorithm class 34 2.2.3 Convergence analysis 35 2.3 Optimal acceleration 39 2.3.1 Algorithms 40 2.3.2 Convergence analysis 41 2.4 Stochastic optimal acceleration 45 2.4.1 Algorithm 45 2.4.2 Convergence analysis 47 2.5 Numerical experiments 50 2.5.1 Model problems 50 2.5.2 Convergence behavior 52 2.5.3 Scalability 62 2.6 Discussion 63 Chapter 3 Towards Unified Programming for High-Performance Statistical Computing Environments 66 3.1 Introduction 66 3.2 Related Software 69 3.2.1 Message-passing interface and distributed array interfaces 69 3.2.2 Unified array interfaces for CPU and GPU 69 3.3 Easy-to-use Software Libraries for HPC 70 3.3.1 Deep learning libraries and HPC 70 3.3.2 Case study: PyTorch versus TensorFlow 73 3.3.3 A brief introduction to PyTorch 76 3.3.4 A brief introduction to Julia 80 3.3.5 Methods and multiple dispatch 80 3.3.6 Multidimensional arrays 82 3.3.7 Matrix multiplication 83 3.3.8 Dot syntax for vectorization 86 3.4 Distributed matrix data structure 87 3.4.1 Distributed matrices in PyTorch: distmat 87 3.4.2 Distributed arrays in Julia: MPIArray 90 3.5 Examples 98 3.5.1 Nonnegative matrix factorization 100 3.5.2 Positron emission tomography 109 3.5.3 Multidimensional scaling 113 3.5.4 L1-regularized Cox regression 117 3.5.5 Genome-wide survival analysis of the UK Biobank dataset 121 3.6 Discussion 126 Chapter 4 Conclusion 131 Appendix A Monotone Operator Theory 134 Appendix B Proofs for Chapter II 139 B.1 Preconditioned forward-backward splitting 139 B.2 Optimal acceleration 147 B.3 Optimal stochastic acceleration 158 Appendix C AWS EC2 and ParallelCluster 168 C.1 Overview 168 C.2 Glossary 169 C.3 Prerequisites 172 C.4 Installation 173 C.5 Configuration 173 C.6 Creating, accessing, and destroying the cluster 178 C.7 Installation of libraries 178 C.8 Running a job 179 C.9 Miscellaneous 180 Appendix D Code for memory-efficient L1-regularized Cox proportional hazards model 182 Appendix E Details of SNPs selected in L1-regularized Cox regression 184 Bibliography 188 국문초록 212Docto

Image Processing and Machine Learning for Hyperspectral Unmixing: An Overview and the HySUPP Python Package

Spectral pixels are often a mixture of the pure spectra of the materials, called endmembers, due to the low spatial resolution of hyperspectral sensors, double scattering, and intimate mixtures of materials in the scenes. Unmixing estimates the fractional abundances of the endmembers within the pixel. Depending on the prior knowledge of endmembers, linear unmixing can be divided into three main groups: supervised, semi-supervised, and unsupervised (blind) linear unmixing. Advances in Image processing and machine learning substantially affected unmixing. This paper provides an overview of advanced and conventional unmixing approaches. Additionally, we draw a critical comparison between advanced and conventional techniques from the three categories. We compare the performance of the unmixing techniques on three simulated and two real datasets. The experimental results reveal the advantages of different unmixing categories for different unmixing scenarios. Moreover, we provide an open-source Python-based package available at https://github.com/BehnoodRasti/HySUPP to reproduce the results

HPC algorithms for nonnegative decompositions

Muchos problemas procedentes de aplicaciones del mundo real pueden ser modelados como problemas matemáticos con magnitudes no negativas, y por tanto, las soluciones de estos problemas matemáticos solo tienen sentido si son no negativas. Estas magnitudes no negativas pueden ser, por ejemplo, las frecuencias en una señal sonora, las intensidades de los pixeles de una imagen, etc. Algunos de estos problemas pueden ser modelados utilizando un sistema de ecuaciones lineales sobredeterminado. Cuando la solución de dicho problema debe ser restringida a valores no negativos, aparece un problema llamado problema de mínimos cuadrados no negativos (NNLS por sus siglas en inglés). La solución de dicho problema tiene múltiples aplicaciones en ciencia e ingeniería. Otra descomposición no negativa importante es la Factorización de Matrices No negativas (NMF por sus siglas en inglés). La NMF es una herramienta muy popular utilizada en varios campos, como por ejemplo: clasificación de documentos, aprendizaje automático, análisis de imagen o separación de señales sonoras. Esta factorización intenta aproximar una matriz no negativa con el producto de dos matrices no negativas de menor tamaño, creando habitualmente representaciones por partes de los datos originales. Los algoritmos diseñados para calcular la solución de estos dos problemas no negativos tienen un elevado coste computacional, y debido a ese elevado coste, estas descomposiciones pueden beneficiarse mucho del uso de técnicas de Computación de Altas Prestaciones (HPC por sus siglas en inglés). Estos sistemas computacionales de altas prestaciones incluyen desde los modernos computadores multinucleo a lo último en aceleradores de calculo (Unidades de Procesamiento Gráfico (GPU), Intel Many Integrated Core (MIC), etc.). Para obtener el máximo rendimiento de estos sistemas, los desarrolladores deben utilizar tecnologías software tales como la programación paralela, la vectoración o el uso de librerías de computación altas prestaciones. A pesar de que existen diversos algoritmos para calcular la NMF y resolver el problema NNLS, no todos ellos disponen de una implementación paralela y eficiente. Además, es muy interesante reunir diversos algoritmos con propiedades diferentes en una sola librería computacional. Esta tesis presenta una librería computacional de altas prestaciones que contiene implementaciones paralelas y eficientes de los mejores algoritmos existentes actualmente para calcular la NMF. Además la tesis también incluye una comparación experimental entre las diferentes implementaciones presentadas. Esta librería centrada en el cálculo de la NMF soporta múltiples arquitecturas tales como CPUs multinucleo, GPUs e Intel MIC. El objetivo de esta librería es ofrecer un abanico de algoritmos eficientes para ayudar a científicos, ingenieros o cualquier tipo de profesionales que necesitan hacer uso de la NMF. Otro problema abordado en esta tesis es la actualización de las factorizaciones no negativas. El problema de la actualización se ha estudiado tanto para la solución del problema NNLS como para el calculo de la NMF. Existen problemas no negativos cuya solución es próxima a otros problemas que ya han sido resueltos, el problema de la actualización consiste en aprovechar la solución de un problema A que ya ha sido resuelto, para obtener la solución de un problema B cercano al problema A. Utilizando esta aproximación, el problema B puede ser resuelto más rápido que si se tuviera que resolver sin aprovechar la solución conocida del problema A. En esta tesis se presenta una metodología algorítmica para resolver ambos problemas de actualización: la actualización de la solución del problema NNLS y la actualización de la NMF. Además se presentan evaluaciones empíricas de las soluciones presentadas para ambos problemas. Los resultados de estas evaluaciones muestran que los algoritmos propuestos son más rápidos que resoMolts problemes procedents de aplicacions del mon real poden ser modelats com problemes matemàtics en magnituts no negatives, i per tant, les solucions de estos problemes matemàtics només tenen sentit si son no negatives. Estes magnituts no negatives poden ser, per eixemple, la concentració dels elements en un compost químic, les freqüències en una senyal sonora, les intensitats dels pixels de una image, etc. Alguns d'estos problemes poden ser modelats utilisant un sistema d'equacions llineals sobredeterminat. Quant la solució de este problema deu ser restringida a valors no negatius, apareix un problema nomenat problema de mínims quadrats no negatius (NNLS per les seues sigles en anglés). La solució de este problema te múltiples aplicacions en ciències i ingenieria. Un atra descomposició no negativa important es la Factorisació de Matrius No negatives(NMF per les seues sigles en anglés). La NMF es una ferramenta molt popular utilisada en diversos camps, com per eixemple: classificacio de documents, aprenentage automàtic, anàlisis de image o separació de senyals sonores. Esta factorisació intenta aproximar una matriu no negativa en el producte de dos matrius no negatives de menor tamany, creant habitualment representacions a parts de les dades originals. Els algoritmes dissenyats per a calcular la solució de estos dos problemes no negatius tenen un elevat cost computacional, i degut a este elevat cost, estes descomposicions poden beneficiar-se molt del us de tècniques de Computació de Altes Prestacions (HPC per les seues sigles en anglés). Estos sistemes de computació de altes prestacions inclouen des dels moderns computadors multinucli a lo últim en acceleradors de càlcul (Unitats de Processament Gràfic (GPU), Intel Many Core (MIC), etc.). Per a obtindre el màxim rendiment de estos sistemes, els desenrolladors deuen utilisar tecnologies software tals com la programació paralela, la vectorisació o el us de llibreries de computació de altes prestacions. A pesar de que existixen diversos algoritmes per a calcular la NMF i resoldre el problema NNLS, no tots ells disponen de una implementació paralela i eficient. Ademés, es molt interessant reunir diversos algoritmes en propietats diferents en una sola llibreria computacional. Esta tesis presenta una llibreria computacional de altes prestacions que conté implementacions paraleles i eficients dels millors algoritmes existents per a calcular la NMF. Ademés, la tesis també inclou una comparació experimental entre les diferents implementacions presentades. Esta llibreria centrada en el càlcul de la NMF soporta diverses arquitectures tals com CPUs multinucli, GPUs i Intel MIC. El objectiu de esta llibreria es oferir una varietat de algoritmes eficients per a ajudar a científics, ingeniers o qualsevol tipo de professionals que necessiten utilisar la NMF. Un atre problema abordat en esta tesis es la actualisació de les factorisacions no negatives. El problema de la actualisació se ha estudiat tant per a la solució del problema NNLS com per a el càlcul de la NMF. Existixen problemes no negatius la solució dels quals es pròxima a atres problemes no negatius que ya han sigut resolts, el problema de la actualisació consistix en aprofitar la solució de un problema A que ya ha sigut resolt, per a obtindre la solució de un problema B pròxim al problema A. Utilisant esta aproximació, el problema B pot ser resolt molt mes ràpidament que si tinguera que ser resolt des de 0 sense aprofitar la solució coneguda del problema A. En esta tesis es presenta una metodologia algorítmica per a resoldre els dos problemes de actualisació: la actualisació de la solució del problema NNLS i la actualisació de la NMF. Ademés es presenten evaluacions empíriques de les solucions presentades per als dos problemes. Els resultats de estes evaluacions mostren que els algoritmes proposts son més ràpits que resoldre el problema des de 0 en tots elsMany real world-problems can be modelled as mathematical problems with nonnegative magnitudes, and, therefore, the solutions of these problems are meaningful only if their values are nonnegative. Examples of these nonnegative magnitudes are the concentration of components in a chemical compound, frequencies in an audio signal, pixel intensities on an image, etc. Some of these problems can be modelled to an overdetermined system of linear equations. When the solution of this system of equations should be constrained to nonnegative values, a new problem arises. This problem is called the Nonnegative Least Squares (NNLS) problem, and its solution has multiple applications in science and engineering, especially for solving optimization problems with nonnegative restrictions. Another important nonnegativity constrained decomposition is the Nonnegative Matrix Factorization (NMF). The NMF is a very popular tool in many fields such as document clustering, data mining, machine learning, image analysis, chemical analysis, and audio source separation. This factorization tries to approximate a nonnegative data matrix with the product of two smaller nonnegative matrices, usually creating parts based representations of the original data. The algorithms that are designed to compute the solution of these two nonnegative problems have a high computational cost. Due to this high cost, these decompositions can benefit from the extra performance obtained using High Performance Computing (HPC) techniques. Nowadays, there are very powerful computational systems that offer high performance and can be used to solve extremely complex problems in science and engineering. From modern multicore CPUs to the newest computational accelerators (Graphics Processing Units(GPU), Intel Many Integrated Core(MIC), etc.), the performance of these systems keeps increasing continuously. To make the most of the hardware capabilities of these HPC systems, developers should use software technologies such as parallel programming, vectorization, or high performance computing libraries. While there are several algorithms for computing the NMF and for solving the NNLS problem, not all of them have an efficient parallel implementation available. Furthermore, it is very interesting to group several algorithms with different properties into a single computational library. This thesis presents a high-performance computational library with efficient parallel implementations of the best algorithms to compute the NMF in the current state of the art. In addition, an experimental comparison between the different implementations is presented. This library is focused on the computation of the NMF supporting multiple architectures like multicore CPUs, GPUs and Intel MIC. The goal of the library is to offer a full suit of algorithms to help researchers, engineers or professionals that need to use the NMF. Another problem that is dealt with in this thesis is the updating of nonnegative decompositions. The updating problem has been studied for both the solution of the NNLS problem and the NMF. Sometimes there are nonnegative problems that are close to other nonnegative problems that have already been solved. The updating problem tries to take advantage of the solution of a problem A, that has already been solved in order to obtain a solution of a new problem B, which is closely related to problem A. With this approach, problem B can be solved faster than solving it from scratch and not taking advantage of the already known solution of problem A. In this thesis, an algorithmic scheme is proposed for both the updating of the solution of NNLS problems and the updating of the NMF. Empirical evaluations for both updating problems are also presented. The results show that the proposed algorithms are faster than solving the problems from scratch in all of the tested cases.San Juan Sebastián, P. (2018). HPC algorithms for nonnegative decompositions [Tesis doctoral no publicada]. Universitat Politècnica de València. https://doi.org/10.4995/Thesis/10251/11306