Understanding Parallel Samplers in Masked Diffusion via Random Walks on Graphs

Inference-time scaling is a promising paradigm to improve generative models, especially when outputs must satisfy structural constraints or optimize downstream rewards. We consider Masked Diffusion Model (MDM) and introduce MDM-VGB, a discrete diffusion sampler that augments unmasking generation with theoretically principled reward-guided remasking. Inspired by the recent success of the classical Jerrum-Sinclair backtracking Markov chain in reward-tilted generation, MDM-VGB extends the backtracking random walk from a fixed prefix tree to a masked-state graph, allowing tokens to be unmasked and remasked at arbitrary positions. The resulting sampler favors unmasking and remasking moves that lead to higher-value partial configurations, enabling both effective high-reward generation and efficient repair of low-reward samples. We prove that MDM-VGB is robust to process-verifier noise and achieves quadratic complexity, while popular test-time heuristics such as best-of-$N$ can incur exponential complexity due to error accumulation. Our theoretical findings are corroborated by strong empirical performance, particularly on popular constraint-satisfaction and scientific benchmarks such as Sudoku and QM9.

Masked diffusion language models can reduce inference steps by revealing multiple tokens per denoising iteration, but this parallelism is fragile: positions that are individually confident may be unsafe to commit together when their predictions are coupled. Existing training-free samplers such as Top-$k$, Fast-dLLM, and EB-Sampler mainly control how many tokens to reveal, while often ranking candidates by token-wise scores that ignore interactions within the selected set. We propose ADAS, a training-free reranking rule that leaves the base sampler's stopping rule unchanged and greedily discounts each token-wise confidence score according to its attention to already selected positions, weighted by their prediction uncertainty. Across LLaDA-8B-Base and Dream-7B-Base on the reasoning benchmarks GSM8K and MATH500 and the code benchmarks HumanEval and MBPP, plugging ADAS into all three samplers improves low-NFE performance at matched denoiser evaluations by $9.11$ and $10.46$ percentage points on average, respectively, with $3.1\%$ per-forward runtime overhead. Code is available at https://github.com/yusufsahin99/ADAS.

A popular selling point of diffusion large language models (dLLMs) is their capacity for parallelism: the ability to generate sequences of text far more efficiently than autoregressive models, which require one forward pass per token. Yet among the many competing paradigms for dLLMs, from masked to uniform to Gaussian diffusion, principled understanding of how these different proposals compare in parallelism remains limited. In this work, we initiate a fine-grained comparison of the capacity for parallelism among these three leading approaches and prove the following: - Uniform and Gaussian diffusion can sample in a number of forward passes which scales with the dual total correlation of the underlying distribution, a measure of intrinsic complexity which can be much smaller than the context length. Previously, it was only known how to achieve this using masked diffusion. - For a certain family of random empirical measures, we show that $\widetildeΘ(\sqrt{d})$ forward passes are necessary and sufficient to sample using uniform or Gaussian diffusion, yet there exist approximate score oracles for which $\widetildeΩ(d)$ forward passes are needed for masked diffusion. This establishes the first provable separation in parallelism between the three prevailing dLLM paradigms. Contrary to popular intuition that masked diffusions are harder to parallelize because they must commit to token values, the latter separation instead comes from the fact that the critical windows in masked diffusion sampling are asymptotically narrower than those in uniform and Gaussian diffusion sampling.