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Minsu Kim

Alumni

Publications

Synthesizable Molecular Generation via Soft-constrained GFlowNets with Rich Chemical Priors
D. Biton
Louis Vaillancourt
Yves V. Brun
Improved Off-policy Reinforcement Learning in Biological Sequence Design
Designing biological sequences with desired properties is challenging due to vast search spaces and limited evaluation budgets. Although rei… (see more)nforcement learning methods use proxy models for rapid reward evaluation, insufficient training data can cause proxy misspecification on out-of-distribution inputs. To address this, we propose a novel off-policy search,
Active Attacks: Red-teaming LLMs via Adaptive Environments
Pierre-Luc St-Charles
Jinkyoo Park
Trajectory Balance with Asynchrony: Decoupling Exploration and Learning for Fast, Scalable LLM Post-Training
Brian Bartoldson
James Diffenderfer
Tal Ben-Nun
Johan Obando-Ceron
Bhavya Kailkhura
Reinforcement learning (RL) is a critical component of large language model (LLM) post-training. However, on-policy algorithms used for post… (see more)-training are not naturally robust to a diversified content of experience replay buffers, which asynchronous off-policy actors can efficiently populate in parallel to training. We propose efficiently learning on such off-policy data via Trajectory Balance with Asynchrony (TBA), an approach to asynchronous RL for LLMs that leverages the principled off-policy TB objective. On math, preference-tuning, and automated red-teaming tasks, we post-train models ranging from Pythia 410M to Qwen 2.5 7B, finding TBA offers speed and performance boosts over strong baselines like Online DPO and Dr. GRPO. Beyond TBA's performance benefits (high accuracy even as asynchrony grows) and speedups (
Adaptive Inference-Time Scaling via Cyclic Diffusion Search
Gyubin Lee
Truong Nhat Nguyen Bao
Jaesik Yoon
Dongwoo Lee
Diffusion models have demonstrated strong generative capabilities across domains ranging from image synthesis to complex reasoning tasks. Ho… (see more)wever, most inference-time scaling methods rely on fixed denoising schedules, limiting their ability to allocate computation based on instance difficulty or task-specific demands adaptively. We introduce the challenge of adaptive inference-time scaling-dynamically adjusting computational effort during inference-and propose Adaptive Bi-directional Cyclic Diffusion (ABCD), a flexible, search-based inference framework. ABCD refines outputs through bi-directional diffusion cycles while adaptively controlling exploration depth and termination. It comprises three components: Cyclic Diffusion Search, Automatic Exploration-Exploitation Balancing, and Adaptive Thinking Time. Experiments show that ABCD improves performance across diverse tasks while maintaining computational efficiency.
Latent Veracity Inference for Identifying Errors in Stepwise Reasoning
Jean-Pierre R. Falet
Oliver E. Richardson
Moksh J. Jain
Sungsoo Ahn
Chain-of-Thought (CoT) reasoning has advanced the capabilities and transparency of language models (LMs); however, reasoning chains can cont… (see more)ain inaccurate statements that reduce performance and trustworthiness. To address this, we propose to augment each reasoning step in a CoT with a latent veracity (or correctness) variable. To efficiently explore this expanded space, we introduce Veracity Search (VS), a discrete search algorithm over veracity assignments. It performs otherwise intractable inference in the posterior distribution over latent veracity values by leveraging the LM's joint likelihood over veracity and the final answer as a proxy reward. This efficient inference-time verification method facilitates supervised fine-tuning of an Amortized Veracity Inference (AVI) machine by providing pseudo-labels for veracity. AVI generalizes VS, enabling accurate zero-shot veracity inference in novel contexts. Empirical results demonstrate that VS reliably identifies errors in logical (ProntoQA), mathematical (GSM8K), and commonsense (CommonsenseQA) reasoning benchmarks, with AVI achieving comparable zero-shot accuracy. Finally, we demonstrate the utility of latent veracity inference for providing feedback during self-correction and self-improvement.
Outsourced Diffusion Sampling: Efficient Posterior Inference in Latent Spaces of Generative Models
Any well-behaved generative model over a variable …
Self-Evolving Curriculum for LLM Reasoning
Offline Model-Based Optimization: Comprehensive Review
Jiayao Gu
Zixuan Liu
Can Chen
Solving Bayesian Inverse Problems with Diffusion Priors and Off-Policy RL
This paper presents a practical application of Relative Trajectory Balance (RTB), a recently introduced off-policy reinforcement learning (R… (see more)L) objective that can asymptotically solve Bayesian inverse problems optimally. We extend the original work by using RTB to train conditional diffusion model posteriors from pretrained unconditional priors for challenging linear and non-linear inverse problems in vision, and science. We use the objective alongside techniques such as off-policy backtracking exploration to improve training. Importantly, our results show that existing training-free diffusion posterior methods struggle to perform effective posterior inference in latent space due to inherent biases.
Adaptive Teachers for Amortized Samplers
Amortized inference is the task of training a parametric model, such as a neural network, to approximate a distribution with a given unnorma… (see more)lized density where exact sampling is intractable. When sampling is implemented as a sequential decision-making process, reinforcement learning (RL) methods, such as generative flow networks, can be used to train the sampling policy. Off-policy RL training facilitates the discovery of diverse, high-reward candidates, but existing methods still face challenges in efficient exploration. We propose to use an adaptive training distribution (the \teacher) to guide the training of the primary amortized sampler (the \student). The \teacher, an auxiliary behavior model, is trained to sample high-loss regions of the \student and can generalize across unexplored modes, thereby enhancing mode coverage by providing an efficient training curriculum. We validate the effectiveness of this approach in a synthetic environment designed to present an exploration challenge, two diffusion-based sampling tasks, and four biochemical discovery tasks demonstrating its ability to improve sample efficiency and mode coverage. Source code is available at https://github.com/alstn12088/adaptive-teacher.
Ant Colony Sampling with GFlowNets for Combinatorial Optimization
We present the Generative Flow Ant Colony Sampler (GFACS), a novel meta-heuristic method that hierarchically combines amortized inference an… (see more)d parallel stochastic search. Our method first leverages Generative Flow Networks (GFlowNets) to amortize a \emph{multi-modal} prior distribution over combinatorial solution space that encompasses both high-reward and diversified solutions. This prior is iteratively updated via parallel stochastic search in the spirit of Ant Colony Optimization (ACO), leading to the posterior distribution that generates near-optimal solutions. Extensive experiments across seven combinatorial optimization problems demonstrate GFACS's promising performances.