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The Fusion of Large Language Models and Formal Methods for Trustworthy AI Agents: A Roadmap

Zhang, Yedi, Cai, Yufan, Zuo, Xinyue, Luan, Xiaokun, Wang, Kailong, Hou, Zhe, Zhang, Yifan, Wei, Zhiyuan, Sun, Meng, Sun, Jun, Sun, Jing, Dong, Jin Song

arXiv.org Artificial Intelligence

Large Language Models (LLMs) have emerged as a transformative AI paradigm, profoundly influencing daily life through their exceptional language understanding and contextual generation capabilities. Despite their remarkable performance, LLMs face a critical challenge: the propensity to produce unreliable outputs due to the inherent limitations of their learning-based nature. Formal methods (FMs), on the other hand, are a well-established computation paradigm that provides mathematically rigorous techniques for modeling, specifying, and verifying the correctness of systems. FMs have been extensively applied in mission-critical software engineering, embedded systems, and cybersecurity. However, the primary challenge impeding the deployment of FMs in real-world settings lies in their steep learning curves, the absence of user-friendly interfaces, and issues with efficiency and adaptability. This position paper outlines a roadmap for advancing the next generation of trustworthy AI systems by leveraging the mutual enhancement of LLMs and FMs. First, we illustrate how FMs, including reasoning and certification techniques, can help LLMs generate more reliable and formally certified outputs. Subsequently, we highlight how the advanced learning capabilities and adaptability of LLMs can significantly enhance the usability, efficiency, and scalability of existing FM tools. Finally, we show that unifying these two computation paradigms -- integrating the flexibility and intelligence of LLMs with the rigorous reasoning abilities of FMs -- has transformative potential for the development of trustworthy AI software systems. We acknowledge that this integration has the potential to enhance both the trustworthiness and efficiency of software engineering practices while fostering the development of intelligent FM tools capable of addressing complex yet real-world challenges.


Hamiltonian Monte Carlo Inference of Marginalized Linear Mixed-Effects Models

Lai, Jinlin, Domke, Justin, Sheldon, Daniel

arXiv.org Machine Learning

Bayesian reasoning in linear mixed-effects models (LMMs) is challenging and often requires advanced sampling techniques like Markov chain Monte Carlo (MCMC). A common approach is to write the model in a probabilistic programming language and then sample via Hamiltonian Monte Carlo (HMC). However, there are many ways a user can transform a model that make inference more or less efficient. In particular, marginalizing some variables can greatly improve inference but is difficult for users to do manually. We develop an algorithm to easily marginalize random effects in LMMs. A naive approach introduces cubic time operations within an inference algorithm like HMC, but we reduce the running time to linear using fast linear algebra techniques. We show that marginalization is always beneficial when applicable and highlight improvements in various models, especially ones from cognitive sciences.


Towards Large Language Model Aided Program Refinement

Cai, Yufan, Hou, Zhe, Luan, Xiaokun, Baena, David Miguel Sanan, Lin, Yun, Sun, Jun, Dong, Jin Song

arXiv.org Artificial Intelligence

Program refinement involves correctness-preserving transformations from formal high-level specification statements into executable programs. Traditional verification tool support for program refinement is highly interactive and lacks automation. On the other hand, the emergence of large language models (LLMs) enables automatic code generations from informal natural language specifications. However, code generated by LLMs is often unreliable. Moreover, the opaque procedure from specification to code provided by LLM is an uncontrolled black box. We propose LLM4PR, a tool that combines formal program refinement techniques with informal LLM-based methods to (1) transform the specification to preconditions and postconditions, (2) automatically build prompts based on refinement calculus, (3) interact with LLM to generate code, and finally, (4) verify that the generated code satisfies the conditions of refinement calculus, thus guaranteeing the correctness of the code. We have implemented our tool using GPT4, Coq, and Coqhammer, and evaluated it on the HumanEval and EvalPlus datasets.


Probabilistic Programming with Programmable Variational Inference

Becker, McCoy R., Lew, Alexander K., Wang, Xiaoyan, Ghavami, Matin, Huot, Mathieu, Rinard, Martin C., Mansinghka, Vikash K.

arXiv.org Artificial Intelligence

Compared to the wide array of advanced Monte Carlo methods supported by modern probabilistic programming languages (PPLs), PPL support for variational inference (VI) is less developed: users are typically limited to a predefined selection of variational objectives and gradient estimators, which are implemented monolithically (and without formal correctness arguments) in PPL backends. In this paper, we propose a more modular approach to supporting variational inference in PPLs, based on compositional program transformation. In our approach, variational objectives are expressed as programs, that may employ first-class constructs for computing densities of and expected values under user-defined models and variational families. We then transform these programs systematically into unbiased gradient estimators for optimizing the objectives they define. Our design enables modular reasoning about many interacting concerns, including automatic differentiation, density accumulation, tracing, and the application of unbiased gradient estimation strategies. Additionally, relative to existing support for VI in PPLs, our design increases expressiveness along three axes: (1) it supports an open-ended set of user-defined variational objectives, rather than a fixed menu of options; (2) it supports a combinatorial space of gradient estimation strategies, many not automated by today's PPLs; and (3) it supports a broader class of models and variational families, because it supports constructs for approximate marginalization and normalization (previously introduced only for Monte Carlo inference). We implement our approach in an extension to the Gen probabilistic programming system (genjax.vi, implemented in JAX), and evaluate on several deep generative modeling tasks, showing minimal performance overhead vs. hand-coded implementations and performance competitive with well-established open-source PPLs.


Exact Bayesian Inference on Discrete Models via Probability Generating Functions: A Probabilistic Programming Approach

Zaiser, Fabian, Murawski, Andrzej S., Ong, Luke

arXiv.org Machine Learning

We present an exact Bayesian inference method for discrete statistical models, which can find exact solutions to a large class of discrete inference problems, even with infinite support and continuous priors. To express such models, we introduce a probabilistic programming language that supports discrete and continuous sampling, discrete observations, affine functions, (stochastic) branching, and conditioning on discrete events. Our key tool is probability generating functions: they provide a compact closed-form representation of distributions that are definable by programs, thus enabling the exact computation of posterior probabilities, expectation, variance, and higher moments. Our inference method is provably correct and fully automated in a tool called Genfer, which uses automatic differentiation (specifically, Taylor polynomials), but does not require computer algebra. Our experiments show that Genfer is often faster than the existing exact inference tools PSI, Dice, and Prodigy. On a range of real-world inference problems that none of these exact tools can solve, Genfer's performance is competitive with approximate Monte Carlo methods, while avoiding approximation errors.


Kochi dementia care center aims to set new paradigm in Japan

The Japan Times

Shinobu Yamanaka apologized the moment this reporter arrived for an interview at a day care facility in the city of Konan, Kochi Prefecture, one muggy morning in July. "Sorry, I had completely forgotten about it," she said with a smile at Day Service Happy, a traditional Japanese-style house converted into a day care center for people with dementia and other health conditions in need of nursing care. "I must leave for another appointment at a local elementary school soon." Yamanaka, a vivacious 46-year-old woman who has her short hair dyed ash blonde, has early-onset Alzheimer's. She often has memory lapses like the one that morning, she later confided.