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Ruijie Zhang

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Artificial Intelligence Machine Learning Distributed, Parallel, and Cluster Computing

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preprint2026arXiv

MolRecBench-Wild: A Real-World Benchmark for Optical Chemical Structure Recognition

Optical Chemical Structure Recognition (OCSR) aims to translate molecular diagrams in scientific literature into machine-readable formats, but current systems remain unreliable on real-world images due to substantial visual and chemical complexity. We introduce MOSAIC, a dual-dimensional difficulty framework with 37 fine-grained labels that jointly characterize visual interference and chemical semantic challenges in molecular diagrams. Based on this framework, we construct MolRecBench-Wild, a benchmark of 5,029 structures from 820 recent chemistry papers, covering the full difficulty spectrum observed in real publications. To enable faithful semantic evaluation beyond SMILES and MolFile, we propose CARBON, a representation language capable of expressing valence variations, icon-based groups, and other non-standard chemical semantics. We further adopt a dual-track evaluation protocol supporting both CARBON and SMILES outputs for broad model compatibility. Comprehensive experiments over 18 OCSR-capable models reveal severe performance degradation on MolRecBench-Wild, exposing a large gap between previous patent benchmarks and real-world academic scenarios.

preprint2026arXiv

MuonQ: Enhancing Low-Bit Muon Quantization via Directional Fidelity Optimization

The Muon optimizer has emerged as a compelling alternative to Adam for training large language models, achieving remarkable computational savings through gradient orthogonalization. However, Muon's optimizer state is more sensitive to quantization errors: because the orthogonalization discards the magnitudes of singular values and retains only directional information, even small quantization errors in singular vector directions are amplified in the update. In this work, we propose MuonQ, a low-bit Muon training framework built on the principle of directional fidelity optimization. First, we apply a pre-quantization normalization so that each step introduces quantization errors of the same magnitude, preventing the accumulated error from developing a preferred direction. Second, we introduce a structural decomposition that separately quantizes the dominant singular components via power iteration, ensuring that quantization errors perturb only singular value magnitudes rather than rotating singular vector directions. Third, we adopt $μ$-law companding quantization to allocate higher resolution to densely packed momentum values, shifting the quantization objective from outlier preservation to dense-region distinguishability. Together, these techniques enable stable 4-bit quantization of Muon's optimizer states. Pre-training experiments on GPT-style and LLaMA-style models demonstrate that MuonQ at 4-bit precision closely matches full-precision Muon in both training loss and downstream task accuracy, while reducing optimizer state memory by up to 7.3 $\times$. Our code is available at https://github.com/YupengSu/MuonQ.

preprint2026arXiv

ReCoVer: Resilient LLM Pre-Training System via Fault-Tolerant Collective and Versatile Workload

Pre-training large language models on massive GPU clusters has made hardware faults routine rather than rare, driving the need for resilient training systems. Yet existing frameworks either focus on specific parallelism schemes or risk drifting away from a failure-free training trajectory. We propose ReCoVer, a resilient LLM pre-training system that upholds a single invariant: each iteration keeps the number of microbatches constant, ensuring per-iteration gradients remain stochastically equivalent to a failure-free run. The framework is organized as three decoupled protocol layers: (1) Fault-tolerant collectives that isolate faults from propagating across replicas; (2) in-step fine-grained recovery that preserves intra-iteration progress and prevents gradient corruption; (3) versatile-workload policy that dynamically redistributes microbatch quotas across the survivors. The design is parallelism-agnostic, integrating directly with both 3D parallelism and Hybrid Sharded Data Parallel (HSDP) as a drop-in substrate. We evaluate our implementation on end-to-end pre-training tasks for up to 512 GPUs, ReCoVer successfully preserves the training trajectory from a failure-free reference despite of 256 GPUs lost spread across the run. For comparison with checkpoint-and-restart baselines, ReCoVer demonstrates $2.23\times$ higher effective throughput after successive failures. This advantage results in ReCoVer processing 74.9% more tokens at 234 GPU-hours, with the gap widening as the training prolongs.

preprint2026arXiv

When Does Value-Aware KV Eviction Help? A Fixed-Contract Diagnostic for Non-Monotone Cache Compression

Long-context LLM inference is bottlenecked by the memory and bandwidth cost of reading large KV caches during decoding. KV compression reduces this cost by keeping only part of the cache, but task accuracy alone does not identify why a selector succeeds or fails. A selector can fail at three steps: it may miss the evidence future decoding needs, give high scores to tokens that do not affect the output, or break related evidence when fitting scores into a small cache. We introduce a fixed-contract diagnostic that holds the selector's setup fixed and changes one decision slot at a time. For value ranking, the probe combines a block's attention mass with the estimated output change from removing it. On LongBench across three models and two budgets, the probe is positive on 72.6% of positive-margin cells and 32.4% of nonpositive-margin cells. NeedleBench M-RT at 32k and a RULER 8k check probe support closure under branched retrieval, and a 264-cell sign evaluation separates support recovery and output-value ranking from leverage effects near the boundary. The resulting order is to recover decode-side evidence, rank its output value, and preserve coupled evidence during projection.

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