Uncertainty
CURTAINs Flows For Flows: Constructing Unobserved Regions with Maximum Likelihood Estimation
Sengupta, Debajyoti, Klein, Samuel, Raine, John Andrew, Golling, Tobias
Model independent techniques for constructing background data templates using generative models have shown great promise for use in searches for new physics processes at the LHC. We introduce a major improvement to the CURTAINs method by training the conditional normalizing flow between two side-band regions using maximum likelihood estimation instead of an optimal transport loss. The new training objective improves the robustness and fidelity of the transformed data and is much faster and easier to train. We compare the performance against the previous approach and the current state of the art using the LHC Olympics anomaly detection dataset, where we see a significant improvement in sensitivity over the original CURTAINs method. Furthermore, CURTAINsF4F requires substantially less computational resources to cover a large number of signal regions than other fully data driven approaches. When using an efficient configuration, an order of magnitude more models can be trained in the same time required for ten signal regions, without a significant drop in performance.
On the Fusion Strategies for Federated Decision Making
Kayaalp, Mert, Inan, Yunus, Koivunen, Visa, Telatar, Emre, Sayed, Ali H.
ABSTRACT We consider the problem of information aggregation in federated decision making, where a group of agents collaborate to infer the underlying state of nature without sharing their private data with the central processor or each other. We analyze the non-Bayesian social learning strategy in which agents incorporate their individual observations into their opinions (i.e., soft-decisions) with Bayes rule, and the central processor aggregates these opinions by arithmetic or geometric averaging. Building on our previous work, we establish that both pooling strategies result in asymptotic normality characterization of the system, which, for instance, can be utilized to derive approximate expressions for the error probability. We verify the theoretical findings with simulations and compare both strategies. Figure 1: Data types at the edge devices can be highly heterogeneous.
Fast parameter estimation of Generalized Extreme Value distribution using Neural Networks
Rai, Sweta, Hoffman, Alexis, Lahiri, Soumendra, Nychka, Douglas W., Sain, Stephan R., Bandyopadhyay, Soutir
The heavy-tailed behavior of the generalized extreme-value distribution makes it a popular choice for modeling extreme events such as floods, droughts, heatwaves, wildfires, etc. However, estimating the distribution's parameters using conventional maximum likelihood methods can be computationally intensive, even for moderate-sized datasets. To overcome this limitation, we propose a computationally efficient, likelihood-free estimation method utilizing a neural network. Through an extensive simulation study, we demonstrate that the proposed neural network-based method provides Generalized Extreme Value (GEV) distribution parameter estimates with comparable accuracy to the conventional maximum likelihood method but with a significant computational speedup. To account for estimation uncertainty, we utilize parametric bootstrapping, which is inherent in the trained network. Finally, we apply this method to 1000-year annual maximum temperature data from the Community Climate System Model version 3 (CCSM3) across North America for three atmospheric concentrations: 289 ppm $\mathrm{CO}_2$ (pre-industrial), 700 ppm $\mathrm{CO}_2$ (future conditions), and 1400 ppm $\mathrm{CO}_2$, and compare the results with those obtained using the maximum likelihood approach.
DPM-Solver++: Fast Solver for Guided Sampling of Diffusion Probabilistic Models
Lu, Cheng, Zhou, Yuhao, Bao, Fan, Chen, Jianfei, Li, Chongxuan, Zhu, Jun
Diffusion probabilistic models (DPMs) have achieved impressive success in high-resolution image synthesis, especially in recent large-scale text-to-image generation applications. An essential technique for improving the sample quality of DPMs is guided sampling, which usually needs a large guidance scale to obtain the best sample quality. The commonly-used fast sampler for guided sampling is DDIM, a first-order diffusion ODE solver that generally needs 100 to 250 steps for high-quality samples. Although recent works propose dedicated high-order solvers and achieve a further speedup for sampling without guidance, their effectiveness for guided sampling has not been well-tested before. In this work, we demonstrate that previous high-order fast samplers suffer from instability issues, and they even become slower than DDIM when the guidance scale grows large. To further speed up guided sampling, we propose DPM-Solver++, a high-order solver for the guided sampling of DPMs. DPM-Solver++ solves the diffusion ODE with the data prediction model and adopts thresholding methods to keep the solution matches training data distribution. We further propose a multistep variant of DPM-Solver++ to address the instability issue by reducing the effective step size. Experiments show that DPM-Solver++ can generate high-quality samples within only 15 to 20 steps for guided sampling by pixel-space and latent-space DPMs.
A Comprehensive Survey on Enterprise Financial Risk Analysis from Big Data Perspective
Zhao, Yu, Du, Huaming, Li, Qing, Zhuang, Fuzhen, Liu, Ji, Kou, Gang
Enterprise financial risk analysis aims at predicting the future financial risk of enterprises. Due to its wide and significant application, enterprise financial risk analysis has always been the core research topic in the fields of Finance and Management. Based on advanced computer science and artificial intelligence technologies, enterprise risk analysis research is experiencing rapid developments and making significant progress. Therefore, it is both necessary and challenging to comprehensively review the relevant studies. Although there are already some valuable and impressive surveys on enterprise risk analysis from the perspective of Finance and Management, these surveys introduce approaches in a relatively isolated way and lack recent advances in enterprise financial risk analysis. In contrast, this paper attempts to provide a systematic literature survey of enterprise risk analysis approaches from Big Data perspective, which reviews more than 250 representative articles in the past almost 50 years (from 1968 to 2023). To the best of our knowledge, this is the first and only survey work on enterprise financial risk from Big Data perspective. Specifically, this survey connects and systematizes the existing enterprise financial risk studies, i.e. to summarize and interpret the problems, methods, and spotlights in a comprehensive way. In particular, we first introduce the issues of enterprise financial risks in terms of their types,granularity, intelligence, and evaluation metrics, and summarize the corresponding representative works. Then, we compare the analysis methods used to learn enterprise financial risk, and finally summarize the spotlights of the most representative works. Our goal is to clarify current cutting-edge research and its possible future directions to model enterprise risk, aiming to fully understand the mechanisms of enterprise risk generation and contagion.
Materials Informatics: An Algorithmic Design Rule
We have researched the organic semiconductor's enigmas through the material informatics approach. By applying diverse neural network topologies, logical axiom, and inferencing information science, we have developed data-driven procedures for novel organic semiconductor discovery for the semiconductor industry and knowledge extraction for the material science community. We have reviewed and corresponded with various algorithms for the neural network design topology for the material informatics dataset, as shown in Figure 1, a generalized neural network topology. We have used four chemical compound space databases for model training and validation in this research notebook. The first one is the general quantum chemistry structures and properties of 134-kilo molecules (QM9) of computed geometric, energetic, electronic, and thermodynamic properties for 134-kilo stable small organic molecules made up of C, H, O, N, F for the novel design of new drugs and materials.
Variational Nonlinear Kalman Filtering with Unknown Process Noise Covariance
Lan, Hua, Hu, Jinjie, Wang, Zengfu, Cheng, Qiang
Motivated by the maneuvering target tracking with sensors such as radar and sonar, this paper considers the joint and recursive estimation of the dynamic state and the time-varying process noise covariance in nonlinear state space models. Due to the nonlinearity of the models and the non-conjugate prior, the state estimation problem is generally intractable as it involves integrals of general nonlinear functions and unknown process noise covariance, resulting in the posterior probability distribution functions lacking closed-form solutions. This paper presents a recursive solution for joint nonlinear state estimation and model parameters identification based on the approximate Bayesian inference principle. The stochastic search variational inference is adopted to offer a flexible, accurate, and effective approximation of the posterior distributions. We make two contributions compared to existing variational inference-based noise adaptive filtering methods. First, we introduce an auxiliary latent variable to decouple the latent variables of dynamic state and process noise covariance, thereby improving the flexibility of the posterior inference. Second, we split the variational lower bound optimization into conjugate and non-conjugate parts, whereas the conjugate terms are directly optimized that admit a closed-form solution and the non-conjugate terms are optimized by natural gradients, achieving the trade-off between inference speed and accuracy. The performance of the proposed method is verified on radar target tracking applications by both simulated and real-world data.
Mixtures of Gaussian process experts based on kernel stick-breaking processes
Mixtures of Gaussian process experts is a class of models that can simultaneously address two of the key limitations inherent in standard Gaussian processes: scalability and predictive performance. In particular, models that use Dirichlet processes as gating functions permit straightforward interpretation and automatic selection of the number of experts in a mixture. While the existing models are intuitive and capable of capturing non-stationarity, multi-modality and heteroskedasticity, the simplicity of their gating functions may limit the predictive performance when applied to complex data-generating processes. Capitalising on the recent advancement in the dependent Dirichlet processes literature, we propose a new mixture model of Gaussian process experts based on kernel stick-breaking processes. Our model maintains the intuitive appeal yet improve the performance of the existing models. To make it practical, we design a sampler for posterior computation based on the slice sampling. The model behaviour and improved predictive performance are demonstrated in experiments using six datasets.
Sparsifying Bayesian neural networks with latent binary variables and normalizing flows
Skaaret-Lund, Lars, Storvik, Geir, Hubin, Aliaksandr
Artificial neural networks (ANNs) are powerful machine learning methods used in many modern applications such as facial recognition, machine translation, and cancer diagnostics. A common issue with ANNs is that they usually have millions or billions of trainable parameters, and therefore tend to overfit to the training data. This is especially problematic in applications where it is important to have reliable uncertainty estimates. Bayesian neural networks (BNN) can improve on this, since they incorporate parameter uncertainty. In addition, latent binary Bayesian neural networks (LBBNN) also take into account structural uncertainty by allowing the weights to be turned on or off, enabling inference in the joint space of weights and structures. In this paper, we will consider two extensions to the LBBNN method: Firstly, by using the local reparametrization trick (LRT) to sample the hidden units directly, we get a more computationally efficient algorithm. More importantly, by using normalizing flows on the variational posterior distribution of the LBBNN parameters, the network learns a more flexible variational posterior distribution than the mean field Gaussian. Experimental results show that this improves predictive power compared to the LBBNN method, while also obtaining more sparse networks. We perform two simulation studies. In the first study, we consider variable selection in a logistic regression setting, where the more flexible variational distribution leads to improved results. In the second study, we compare predictive uncertainty based on data generated from two-dimensional Gaussian distributions. Here, we argue that our Bayesian methods lead to more realistic estimates of predictive uncertainty.
Synthesizing PET images from High-field and Ultra-high-field MR images Using Joint Diffusion Attention Model
Xie, Taofeng, Cao, Chentao, Cui, Zhuoxu, Guo, Yu, Wu, Caiying, Wang, Xuemei, Li, Qingneng, Hu, Zhanli, Sun, Tao, Sang, Ziru, Zhou, Yihang, Zhu, Yanjie, Liang, Dong, Jin, Qiyu, Chen, Guoqing, Wang, Haifeng
MRI and PET are crucial diagnostic tools for brain diseases, as they provide complementary information on brain structure and function. However, PET scanning is costly and involves radioactive exposure, resulting in a lack of PET. Moreover, simultaneous PET and MRI at ultra-high-field are currently hardly infeasible. Ultra-high-field imaging has unquestionably proven valuable in both clinical and academic settings, especially in the field of cognitive neuroimaging. These motivate us to propose a method for synthetic PET from high-filed MRI and ultra-high-field MRI. From a statistical perspective, the joint probability distribution (JPD) is the most direct and fundamental means of portraying the correlation between PET and MRI. This paper proposes a novel joint diffusion attention model which has the joint probability distribution and attention strategy, named JDAM. JDAM has a diffusion process and a sampling process. The diffusion process involves the gradual diffusion of PET to Gaussian noise by adding Gaussian noise, while MRI remains fixed. JPD of MRI and noise-added PET was learned in the diffusion process. The sampling process is a predictor-corrector. PET images were generated from MRI by JPD of MRI and noise-added PET. The predictor is a reverse diffusion process and the corrector is Langevin dynamics. Experimental results on the public Alzheimer's Disease Neuroimaging Initiative (ADNI) dataset demonstrate that the proposed method outperforms state-of-the-art CycleGAN for high-field MRI (3T MRI). Finally, synthetic PET images from the ultra-high-field (5T MRI and 7T MRI) be attempted, providing a possibility for ultra-high-field PET-MRI imaging.