Uncertainty
Variational Bayesian Phylogenetic Inference with Semi-implicit Branch Length Distributions
Xie, Tianyu, Matsen, Frederick A. IV, Suchard, Marc A., Zhang, Cheng
Reconstructing the evolutionary history relating a collection of molecular sequences is the main subject of modern Bayesian phylogenetic inference. However, the commonly used Markov chain Monte Carlo methods can be inefficient due to the complicated space of phylogenetic trees, especially when the number of sequences is large. An alternative approach is variational Bayesian phylogenetic inference (VBPI) which transforms the inference problem into an optimization problem. While effective, the default diagonal lognormal approximation for the branch lengths of the tree used in VBPI is often insufficient to capture the complexity of the exact posterior. In this work, we propose a more flexible family of branch length variational posteriors based on semi-implicit hierarchical distributions using graph neural networks. We show that this semi-implicit construction emits straightforward permutation equivariant distributions, and therefore can handle the non-Euclidean branch length space across different tree topologies with ease. To deal with the intractable marginal probability of semi-implicit variational distributions, we develop several alternative lower bounds for stochastic optimization. We demonstrate the effectiveness of our proposed method over baseline methods on benchmark data examples, in terms of both marginal likelihood estimation and branch length posterior approximation.
Communicate to Play: Pragmatic Reasoning for Efficient Cross-Cultural Communication in Codenames
White, Isadora, Pandey, Sashrika, Pan, Michelle
Cultural differences in common ground may result in pragmatic failure and misunderstandings during communication. We develop our method Rational Speech Acts for Cross-Cultural Communication (RSA+C3) to resolve cross-cultural differences in common ground. To measure the success of our method, we study RSA+C3 in the collaborative referential game of Codenames Duet and show that our method successfully improves collaboration between simulated players of different cultures. Our contributions are threefold: (1) creating Codenames players using contrastive learning of an embedding space and LLM prompting that are aligned with human patterns of play, (2) studying culturally induced differences in common ground reflected in our trained models, and (3) demonstrating that our method RSA+C3 can ease cross-cultural communication in gameplay by inferring sociocultural context from interaction. Our code is publicly available at github.com/icwhite/codenames.
UCB Exploration for Fixed-Budget Bayesian Best Arm Identification
We study best-arm identification (BAI) in the fixed-budget setting. Adaptive allocations based on upper confidence bounds (UCBs), such as UCBE, are known to work well in BAI. However, it is well-known that its optimal regret is theoretically dependent on instances, which we show to be an artifact in many fixed-budget BAI problems. In this paper we propose an UCB exploration algorithm that is both theoretically and empirically efficient for the fixed budget BAI problem under a Bayesian setting. The key idea is to learn prior information, which can enhance the performance of UCB-based BAI algorithm as it has done in the cumulative regret minimization problem. We establish bounds on the failure probability and the simple regret for the Bayesian BAI problem, providing upper bounds of order $\tilde{O}(\sqrt{K/n})$, up to logarithmic factors, where $n$ represents the budget and $K$ denotes the number of arms. Furthermore, we demonstrate through empirical results that our approach consistently outperforms state-of-the-art baselines.
FORGE: Force-Guided Exploration for Robust Contact-Rich Manipulation under Uncertainty
Noseworthy, Michael, Tang, Bingjie, Wen, Bowen, Handa, Ankur, Roy, Nicholas, Fox, Dieter, Ramos, Fabio, Narang, Yashraj, Akinola, Iretiayo
We present FORGE, a method that enables sim-to-real transfer of contact-rich manipulation policies in the presence of significant pose uncertainty. FORGE combines a force threshold mechanism with a dynamics randomization scheme during policy learning in simulation, to enable the robust transfer of the learned policies to the real robot. At deployment, FORGE policies, conditioned on a maximum allowable force, adaptively perform contact-rich tasks while respecting the specified force threshold, regardless of the controller gains. Additionally, FORGE autonomously predicts a termination action once the task has succeeded. We demonstrate that FORGE can be used to learn a variety of robust contact-rich policies, enabling multi-stage assembly of a planetary gear system, which requires success across three assembly tasks: nut-threading, insertion, and gear meshing. Project website can be accessed at https://noseworm.github.io/forge/.
Mathematical Programming For Adaptive Experiments
Che, Ethan, Jiang, Daniel R., Namkoong, Hongseok, Wang, Jimmy
Adaptive experimentation can significantly improve statistical power, but standard algorithms overlook important practical issues including batched and delayed feedback, personalization, non-stationarity, multiple objectives, and constraints. To address these issues, the current algorithm design paradigm crafts tailored methods for each problem instance. Since it is infeasible to devise novel algorithms for every real-world instance, practitioners often have to resort to suboptimal approximations that do not address all of their challenges. Moving away from developing bespoke algorithms for each setting, we present a mathematical programming view of adaptive experimentation that can flexibly incorporate a wide range of objectives, constraints, and statistical procedures. By formulating a dynamic program in the batched limit, our modeling framework enables the use of scalable optimization methods (e.g., SGD and auto-differentiation) to solve for treatment allocations. We evaluate our framework on benchmarks modeled after practical challenges such as non-stationarity, personalization, multi-objectives, and constraints. Unlike bespoke algorithms such as modified variants of Thomson sampling, our mathematical programming approach provides remarkably robust performance across instances.
Connective Viewpoints of Signal-to-Noise Diffusion Models
Doan, Khanh, Vuong, Long Tung, Nguyen, Tuan, Bui, Anh Tuan, Tran, Quyen, Do, Thanh-Toan, Phung, Dinh, Le, Trung
Diffusion models (DM) have become a fundamental part of generative models, which excel in various domains, including creating images, generating audio, and interpolating complex data. The foundational framework for these models was introduced by Sohl-Dickstein et al. (2015), and Ho et al. (2020) further refined it with Denoising Diffusion Probabilistic Models (DDPMs). DDPMs add noise to data iteratively and learn to reverse this process, allowing them to model data distributions effectively. Signal-to-Noise (S2N) diffusion models Kingma and Gao (2024); Kingma et al. (2021) constitute an extensive class of diffusion models encompassing various other models such as variance-preserving (VP) and variance-exploding (VE) DM Song et al. (2020b), iDDPM Nichol and Dhariwal (2021), DDPM Ho et al. (2020), EDM Karras et al. (2022), and continuous variation models Kingma and Gao (2024); Kingma et al. (2021). Numerous efforts have been made to study Signal-to-Noise diffusion models from various perspectives. Notably, Kingma et al. (2021) began with a discrete S2N diffusion model, developed its variational-based backward inference, and finally examined the asymptotic behavior as the number of time steps approaches infinity, resulting in a continuous variational DM.
Zero-Shot Uncertainty Quantification using Diffusion Probabilistic Models
Shu, Dule, Farimani, Amir Barati
The success of diffusion probabilistic models in generative tasks, such as text-to-image generation, has motivated the exploration of their application to regression problems commonly encountered in scientific computing and various other domains. In this context, the use of diffusion regression models for ensemble prediction is becoming a practice with increasing popularity. Under such background, we conducted a study to quantitatively evaluate the effectiveness of ensemble methods on solving different regression problems using diffusion models. We consider the ensemble prediction of a diffusion model as a means for zero-shot uncertainty quantification, since the diffusion models in our study are not trained with a loss function containing any uncertainty estimation. Through extensive experiments on 1D and 2D data, we demonstrate that ensemble methods consistently improve model prediction accuracy across various regression tasks. Notably, we observed a larger accuracy gain in auto-regressive prediction compared with point-wise prediction, and that enhancements take place in both the mean-square error and the physics-informed loss. Additionally, we reveal a statistical correlation between ensemble prediction error and ensemble variance, offering insights into balancing computational complexity with prediction accuracy and monitoring prediction confidence in practical applications where the ground truth is unknown. Our study provides a comprehensive view of the utility of diffusion ensembles, serving as a useful reference for practitioners employing diffusion models in regression problem-solving.
Knowledge-Aided Semantic Communication Leveraging Probabilistic Graphical Modeling
Wan, Haowen, Yang, Qianqian, Tang, Jiancheng, shi, Zhiguo
In this paper, we propose a semantic communication approach based on probabilistic graphical model (PGM). The proposed approach involves constructing a PGM from a training dataset, which is then shared as common knowledge between the transmitter and receiver. We evaluate the importance of various semantic features and present a PGM-based compression algorithm designed to eliminate predictable portions of semantic information. Furthermore, we introduce a technique to reconstruct the discarded semantic information at the receiver end, generating approximate results based on the PGM. Simulation results indicate a significant improvement in transmission efficiency over existing methods, while maintaining the quality of the transmitted images.
Probabilistic Circuits for Cumulative Distribution Functions
Broadrick, Oliver, Cao, William, Wang, Benjie, Trapp, Martin, Broeck, Guy Van den
A probabilistic circuit (PC) succinctly expresses a function that represents a multivariate probability distribution and, given sufficient structural properties of the circuit, supports efficient probabilistic inference. Typically a PC computes the probability mass (or density) function (PMF or PDF) of the distribution. We consider PCs instead computing the cumulative distribution function (CDF). We show that for distributions over binary random variables these representations (PMF and CDF) are essentially equivalent, in the sense that one can be transformed to the other in polynomial time. We then show how a similar equivalence holds for distributions over finite discrete variables using a modification of the standard encoding with binary variables that aligns with the CDF semantics. Finally we show that for continuous variables, smooth, decomposable PCs computing PDFs and CDFs can be efficiently transformed to each other by modifying only the leaves of the circuit.
Intuitionistic Fuzzy Cognitive Maps for Interpretable Image Classification
Sovatzidi, Georgia, Vasilakakis, Michael D., Iakovidis, Dimitris K.
The interpretability of machine learning models is critical, as users may be reluctant to rely on their inferences. Intuitionistic FCMs (iFCMs) have been proposed as an extension of FCMs offering a natural mechanism to assess the quality of their output through the estimation of hesitancy, a concept resembling to human hesitation in decision making. To address the challenge of interpretable image classification, this paper introduces a novel framework, named Interpretable Intuitionistic FCM (I2FCM) which is domain-independent, simple to implement, and can be applied on Convolutional Neural Network (CNN) models, rendering them interpretable. To the best of our knowledge this is the first time iFCMs are applied for image classification. Further novel contributions include: a feature extraction process focusing on the most informative image regions; a learning algorithm for data-driven determination of the intuitionistic fuzzy interconnections of the iFCM; an inherently interpretable classification approach based on image contents. In the context of image classification, hesitancy is considered as a degree of inconfidence with which an image is categorized to a class. The constructed iFCM model distinguishes the most representative image semantics and analyses them utilizing cause-and-effect relations. The effectiveness of the introduced framework is evaluated on publicly available datasets, and the experimental results confirm that it can provide enhanced classification performance, while providing interpretable inferences.