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June 4: Rapid Gaussian Process Training via Structured Low-Rank Kernel Approximation of Gridded Measurements

Date: June 4, 3pm

Speaker: Franklin Fuller

Location: Havasu B53-3004 (Note change!)

Abstract: The cubic scaling of matrix inversion with the number of data points is the main computational cost in Gaussian Process (GP) regression. Sparse GP approaches reduce the complexity of matrix inversion to linear complexity by making an optimized low rank approximation to the kernel, but the quality of the approximation depends (and scales with) how many "inducing" or representative points are allowed. When the problem at hand allows the kernel to be decomposed into a kronecker product of lower dimensional kernels, many more inducing points can be feasibly processed by exploiting the kronecker factorization, resulting in a much higher quality fit. Kronecker factorizations suffer from exponentially scaling with the dimension of the input, however, which has limited this approach to problems of only a few input dimensions. It was recently shown how this problem can be circumvented by making an additional low-rank approximation across input dimensions, resulting in an approach that scales linearly in both data points and the input dimensionality. We explore a special case of this recent work wherein the observed data are measured on a complete multi-dimensional grid (not necessarily uniformly spaced), which is a is very common scenario in scientific measurement environments. In this special case, the problem decomposes over axes of the input grid, making the cost linearly scale mainly with the largest axis of the grid. We apply this approach to deconvolve linearly mixed spectroscopic signals and are able to optimize kernel hyper parameters on datasets containing billions of measurements in minutes with a laptop.

TBD

 

June 25: Machine learning at LLNL (tentative)

Date: June

4

25, 3pm

Speaker: Brian Spears (LLNL)

Location: Havasu B53-3004 (Note change!)

Abstract: TBD

 

TBD: On analyzing urban form at global scale with remote sensing data and generative adversarial networks

Date: TBD

Speaker: Adrian Albert

Abstract: Current analyses of urban development use either simple, bottom-up models, that have limited predictive performance, or highly engineered, complex models relying on many sources of survey data that are typically scarce and difficult and expensive to collect. This talk presents work-in-progress developing a data-driven, flexible, non-parametric framework to simulate realistic urban forms using generative adversarial networks and planetary-level remote-sensing data. To train our urban simulator, we  curate and put forth a new dataset on urban form, integrating spatial distribution maps of population, nighttime luminosity, and built land densities, as well as best-available information on city administrative boundaries for 30,000 of the world's largest cities. This is the first analysis to date of urban form using modern generative models and remote-sensing data.



Past Seminars

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Machine learning applications for hospitals

Date: May 21 at 3pm

Speaker: David Scheinker

Abstract: Academic hospitals and particle accelerators have a lot in common. Both are complex organizations; employ numerous staff and scientists; deliver a variety of services; research how to improve the delivery of those services; and do it all with a variety of large expensive machines. My group focuses on helping the Stanford hospitals, mostly the Children's Hospital, seek to improve: throughput, decision-support, resource management, innovation, and education. I'll present brief overviews of a variety of ML-based approaches to projects in each of these areas. For example, integer programming to optimize surgical scheduling and Neural Networks to interpret continuous-time waveform monitor data. I will conclude with a broader vision for how modern analytics methodology could potentially transform healthcare delivery. More information on the projects to be discussed is available at surf.stanford.edu/projects

Beyond Data and Model Parallelism for Deep Neural Networks

Date: May 7 at 3pm

Speaker: Zhihao Jia

Abstract: Existing deep learning systems parallelize the training process of deep neural networks (DNNs) by using simple strategies, such as data and model parallelism, which usually results in suboptimal parallelization performance for large scale training. In this talk, I will first formalize the space of all possible parallelization strategies for training DNNs. After that, I will present FlexFlow, a deep learning framework that automatically finds efficient parallelization strategies by using a guided random search algorithm to explore the space of all possible parallelization strategies. Finally, I will show that FlexFlow significantly outperforms state-of-the-art parallelization approaches by increasing training throughput, reducing communication costs, and achieving improved scalability.

X-ray spectrometer data processing with unsupervised clustering (Sideband signal seeking)

Date: April 9, 3pm

Speaker: Guanqun Zhou

Abstract: Online spectrometer plays an important role in the characterization of the free-electron laser (FEL) pulse spectrum. With the help of beam synchronization acquisition (BSA) system, the spectrum of independent shot can be stored, which helps the downstream scientific researchers a lot. However, because of spontaneous radiation, FEL intrinsic fluctuations and other stochastic effects, the data from spectrometer cannot be fully utilized. A specific case is sideband signal resolution in hard-xray self-seeding experiment. During the seminar, I will present my exploration of employing unsupervised clustering algorithm to mine the latent information in the spectrometer data. In this way, sideband signal starts to appear.

Experience with FEL taper tuning using reinforcement learning and clustering

Date: April 2, 3pm

Speaker: Juhao Wu

Abstract: LCLS, world’s first hard X-ray Free Electron Laser (FEL) is serving multiple users. It commonly happens that different scientific research requires very different parameters of the X-Ray pulses, therefore setting up the system in a timing fashion meeting these requests is a nontrivial task. Artificial intelligence is not only very helpful to conduct well defined task towards definitive goal, it also helps to find new operating regime generating unexpected great results. Here in this talk, we will report experience with FEL taper tuning using reinforcement learning and clustering. Such study opens up novel taper configuration such as a zig-zag taper which takes full advantages of the filamentation of the electron bunch phase space in the deep saturated regime.

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Statistical Learning of Reduced Kinetic Monte Carlo Models of Complex Chemistry from Molecular Dynamics

Date: Feb. 26, 3pm

Speaker: Qian Yang (Stanford)

Complex chemical processes, such as the decomposition of energetic materials and the chemistry of planetary interiors, are typically studied using large-scale molecular dynamics simulations that can run for weeks on high performance parallel machines. These computations may involve thousands of atoms forming hundreds of molecular species and undergoing thousands of reactions. It is natural to wonder whether this wealth of data can be utilized to build more efficient, interpretable, and predictive models of complex chemistry. In this talk, we will use techniques from statistical learning to develop a framework for constructing Kinetic Monte Carlo (KMC) models from molecular dynamics data. We will show that our KMC models can not only extrapolate the behavior of the chemical system by as much as an order of magnitude in time, but can also be used to study the dynamics of entirely different chemical trajectories with a high degree of fidelity. Then, we will discuss a new and efficient data-driven method using L1-regularization for automatically reducing our learned KMC models from thousands of reactions to a smaller subset that effectively reproduces the dynamics of interest.

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Machine Learning for Jet Physics at the Large Hadron Collider

Date: February 12, 3pm

Speaker: Ben Nachman (CERN)
Abstract: Modern machine learning (ML) has introduced a new and powerful toolkit to High Energy Physics.  While only a small number of these techniques are currently used in practice, research and development centered around modern ML has exploded over the last year(s).  I will highlight recent advances with a focus on jets: collimated sprays of particles resulting from quarks and gluons produced at high energy. Themselves defined by unsupervised learning algorithms, jets are a prime benchmark for state-of-the-art ML applications and innovations.  For example, I will show how deep learning has been applied to jets for classification, regression, and generation.  These tools hold immense potential, but incorporating domain-specific knowledge is necessary for optimal performance.  In addition, studying what the machines are learning is critical for robustness and may even help us learn new physics!
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Tutorial – Implementation Practice of Deep Neural Network Technique into Our Research

Date: Wednesday Jan. 24, 3pm-5pm in Mammoth B53-3036 (Note time and place!)

Speaker: Kazuhiro Terao
Abstract: The progress of machine learning techniques in recent years has been impactful in many fields of research including physics science. While learning more about machine learning subject exciting, an implementation in our research can face a huge learning curve and take time. In this first AI seminar of 2018, I will show our implementation of convolution neural network for analyzing liquid argon time projection chamber (LArTPC) detector data. In particular, we will look at an instance of convolutional neural network trained for semantic-segmentation task (i.e. pixel-level object classification task). This seminar will be in an interactive tutorial style using Jupyter python notebook. In the first part of the seminar, I will give an overview of software stacks and workflow. Then I will demonstrate training the algorithm. Both the software and data will be made available in advance, and the audience is welcome to participate in training the algorithm (which may require an NVIDIA GPU enabled Linux interactive shell such as SLAC computing or AWS service).
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In situ visualization with task-based parallelism

Date: Nov. 27, 3pm

Speaker: Alan Heirich

Abstract: This short paper describes an experimental prototype of in situ visualization in a task-based parallel programming framework.  A set of reusable visualization tasks were composed with an existing simulation.  The visualization tasks include a local OpenGL renderer, a parallel image compositor, and a display task.  These tasks were added to an existing fluid-particle-radiation simulation and weak scaling tests were run on up to 512 nodes of the Piz Daint supercomputer.  Benchmarks showed that the visualization components scaled and did not reduce the simulation throughput.  The compositor latency increased logarithmically with increasing node count.

Data Reconstruction Using Deep Neural Networks for Liquid Argon Time Projection Chamber Detectors

Date: Oct. 16, 3pm

Speaker: Kazuhiro Terao

Deep neural networks (DNNs) have found a vast number of applications ranging from automated human face recognition, real-time object detection for self-driving cars, teaching a robot Chinese, and even playing Go. In this talk, I present our first steps in exploring the use of DNNs to the task of analyzing neutrino events coming from Liquid Argon Time Projection Chambers (LArTPC), in particular the MicroBooNE detector. LArTPCs consist of a large volume of liquid argon sandwiched between a cathode and anode wire planes. These detectors are capable of recording images of charged particle tracks with breathtaking resolution.  Such detailed information will allow LArTPCs to perform accurate particle identification and calorimetry, making it the detector of choice for many current and future neutrino experiments. However, analyzing such images can be challenging, requiring the development of many algorithms to identify and assemble features of the events in order to identify and remove cosmic-ray-induced particles and reconstruct neutrino interactions. This talk shows the current status of DNN applications and our future direction.

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Towards a cosmology emulator using Generative Adversarial Networks

Date: Oct 3, 2pm

Speaker: Mustafa Mustafa

The application of deep learning techniques to generative modeling is renewing interest in using high dimensional density estimators as computationally inexpensive emulators of fully-fledged simulations. These generative models have the potential to make a dramatic shift in the field of scientific simulations, but for that shift to happen we need to study the performance of such generators in the precision regime needed for science applications. To this end, in this talk we apply Generative Adversarial Networks to the problem of generating cosmological weak lensing convergence maps. We show that our generator network produces maps that are described by, with high statistical confidence, the same summary statistics as the fully simulated maps. 

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Optimal Segmentation with Pruned Dynamic Programming

Date: Sept. 12, 2pm

Speaker: Jeffrey Scargle (NASA )

Bayesian Blocks (1207.5578) is an O(N**2) dynamic programming algorithm to compute exact global optimal segmentations of sequential data of arbitrary mode and dimensionality. Multivariate data, generalized block shapes, and higher dimensional data are easily treated. Incorporating a simple pruning method yields a (still exact) O(N) algorithm allowing fast analysis of series of ~100M data points. Sample applications include analysis of X- and gamma-ray time series, identification of GC-islands in the human genome, data-adaptive triggers and histograms, and elucidating the Cosmic Web from 3D galaxy redshift data.

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Fast automated analysis of strong gravitational lenses with convolutional neural networks

Date: Sept. 12, 2pm

Speaker: Yashar Hezaveh

Strong gravitational lensing is a phenomenon in which the image of a distant galaxy appears highly distorted due to the deflection of its light rays by the gravity of a more nearby, intervening galaxy. We often see multiple distinct arc-shaped images of the background galaxy around the intervening (lens) galaxy, just like images in a funhouse mirror. Strong lensing gives astrophysicist a unique opportunity to carry out different investigations, including mapping the detailed distribution of dark matter, or measuring the expansion rate of the universe. All these great sciences, however, require a detailed knowledge of the distribution of matter in the lensing galaxies, measured from the distortions in the images. This has been traditionally performed with maximum-likelihood lens modeling, a procedure in which simulated observations are generated and compared to the data in a statistical way. The parameters controlling the simulations are then explored with samplers like MCMC. This is a time and resource consuming procedure, requiring hundreds of hours of computer and human time for a single system. In this talk, I  will discuss our recent work in which we showed that deep convolutional neural networks can solve this problem more than 10 million times faster: about 0.01 seconds per system on a single GPU. I will also review our method for quantifying the uncertainties of the parameters obtained with these networks. With the advent of upcoming sky surveys such as the Large Synoptic Survey Telescope, we are anticipating the discovery of tens of thousands of new gravitational lenses. Neural networks can be an essential tool for the analysis of such high volumes of data.

MacroBase: A Search Engine for Fast Data Streams

Date: Sept. 5, 2pm

Speaker: Sahaana Suri (Stanford)

While data volumes generated by sensors, automated process, and application telemetry continue to rise, the capacity of human attention remains limited. To harness the potential of these large scale data streams, machines must step in by processing, aggregating, and contextualizing significant behaviors within these data streams. This talk will describe progress towards achieving this goal via MacroBase, a new analytics engine for prioritizing attention in this large-scale "fast data" that has begun to deliver results in several production environments. Key to this progress are new methods for constructing cascades of analytic operators for classification, aggregation, and high-dimensional feature selection; when combined, these cascades yield new opportunities for dramatic scalability improvements via end-to-end optimization for streams spanning time-series, video, and structured data. MacroBase is a core component of the Stanford DAWN project (http://dawn.cs.stanford.edu/), a new research initiative designed to enable more usable and efficient machine learning infrastructure.

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Object-Centric Machine Learning

Date: Aug. 29, 2pm

Speaker: Leo Guibas (Stanford)

Deep knowledge of the world is necessary if we are to have autonomous and intelligent agents and artifacts that can assist us in everyday activities, or even carry out tasks entirely independently. One way to factorize the complexity of the world is to associate information and knowledge with stable entities, animate or inanimate, such as persons or vehicles, etc -- what we generally refer to as "objects."

In this talk I'll survey a number of recent efforts whose aim is to create and annotate reference representations for (inanimate) objects based on 3D models with the aim of delivering such information to new observations, as needed. In this object-centric view, the goal is to learn about object geometry, appearance, articulation, materials, physical properties, affordances, and functionality. We acquire such information in a multitude of ways, both from crowd-sourcing and from establishing direct links between models and signals, such as images, videos, and 3D scans -- and through these to language and text. The purity of the 3D representation allows us to establish robust maps and correspondences for transferring information among the 3D models themselves -- making our current 3D repository, ShapeNet, a true network. 
While neural network architectures have had tremendous impact in image understanding and language processing, their adaptation to 3D data is not entirely straightforward. The talk will also briefly discuss current approaches in designing deep nets appropriate for operating directly on irregular 3D data representations, such as meshes or point clouds, both for analysis and synthesis -- as well as ways to learn object function from observing multiple action sequences involving objects -- in support of the above program.

Reconstruction Algorithms for Next-Generation Imaging: Multi-Tiered Iterative Phasing for Fluctuation X-ray Scattering and Single-Particle Diffraction

Date: Aug. 15, 2pm

Location: Tulare (B53-4006) (NOTE CHANGE IN ROOM!)

Speaker: Jeffrey Donatelli (CAMERA, Berkeley)

Abstract: The development of X-ray free-electron lasers has enabled new experiments to study uncrystallized biomolecules that were previously infeasible with traditional X-ray sources. One such emerging experimental technique is fluctuation X-ray scattering (FXS), where one collects a series of diffraction patterns, each from multiple particles in solution, using ultrashort X-ray pulses that allow snapshots to be taken below rotational diffusion times of the particles. The resulting images contain angularly varying information from which angular correlations can be computed, yielding several orders of magnitude more information than traditional solution scattering methods. However, determining molecular structure from FXS data introduces several challenges, since, in addition to the classical phase problem, one must also solve a hyper-phase problem to determine the 3D intensity function from the correlation data. In another technique known as single-particle diffraction (SPD), several diffraction patterns are collected, each from an individual particle. However, the samples are delivered to the beam at unknown orientations and may also be present in several different conformational states. In order to reconstruct structural information from SPD, one must determine the orientation and state for each image, extract an accurate 3D model of the intensity function from the images, and solve for the missing complex phases, which are not measured in diffraction images.
In this talk, we present the multi-tiered iterative phasing (M-TIP) algorithm for determining molecular structure from both FXS and SPD data. This algorithm breaks up the associated reconstruction problems into a set of simpler subproblems that can be efficiently solved by applying a series of projection operators. These operators are combined in a modular iterative framework which is able to simultaneously determine missing parameters, the 3D intensity function, the complex phases, and the underlying structure from the data. In particular, this approach is able to leverage prior knowledge about the structural model, such as shape or symmetry, to obtain a reconstruction from very limited data with excellent global convergence properties and high computational efficiency. We show results from applying M-TIP to determine molecular structure from both simulated data and experimental data collected at the Linac Coherent Light Source (LCLS).
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Exploratory Studies in Neural Network-based Modeling and Control of Particle Accelerators

Date: Aug 1, 2pm

Speaker: Auralee Edelen (CSU)

Particle accelerators are host to myriad control challenges: they involve a multitude of interacting systems, are often subject to tight performance demands, in many cases exhibit nonlinear behavior, sometimes are not well-characterized due to practical and/or fundamental limitations, and should be able to run for extended periods of time with minimal interruption. One avenue toward improving the way these systems are controlled is to incorporate techniques from machine learning. Within machine learning, neural networks in particular are appealing because they are highly flexible, they are well-suited to problems with nonlinear behavior and large parameter spaces, and their recent success in other fields (driven largely by algorithmic advances, greater availability of large data sets, and improvements in high performance computing resources) is an encouraging indicator that they are now technologically mature enough to be fruitfully applied to particle accelerators. This talk will highlight a few recent efforts in this area that were focused on exploring neural network-based approaches for modeling and control of several particle accelerator subsystems, both through simulation and experimental studies. 

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Estimating behind-the-meter solar generation with existing measurement infrastructure

Date: July 11, 2pm

Speaker: Emre Kara

Real-time PV generation information is crucial for distribution system operations such as switching, 
state-estimation, and voltage management. However, most behind-the-meter solar installations are not 
monitored.Typically, the only information available to the distribution system operator is the installed 
capacity of solar behind each meter; though in many cases even the presence of solar may be unknown. 
We present a method for disaggreagating behind-the-meter solar generation using only information that 
is already available in most distribution systems. Specifically, we present a contextually supervised source 
separation strategy adopted to address the behind-the-meter solar disaggregation problem. We evaluate
the model sensitivities to different input parameters such as the number of solar proxy measurements, number 
of days in the training set, and region size. 

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Development and Application of Online Optimization Algorithms

Date: June 27, 3pm

Location: Kings River, B52-306 (Note change in time and place!)

Speaker: Xiabiao Huang

Automated tuning is an online optimization process.  It can be faster and more efficient than manual tuning and can lead to better performance. It may also substitute or improve upon model based methods. Noise tolerance is a fundamental challenge to online optimization algorithms. We discuss our experience in developing a high efficiency, noise-tolerant optimization algorithm, the RCDS method, and the successful application of the algorithm to various real-life accelerator problems. Experience with a few other online optimization algorithms are also discussed.

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Machine Learning at NERSC: Past, Present, and Future

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