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Oct 6

Beyond Activation Alignment:The Alignment-Diversity Tradeoff in Task-Aware LLM Quantization

Mixed-precision quantization (MPQ) has become a key technique for deploying large language models under stringent memory and compute constraints. We first identify a phenomenon that we term the Perplexity Illusion: layers ranked as important by perplexity-based sensitivity show little rank correlation with those that are most influential for complex reasoning performance, with Kendall τapprox 0 in our analysis. We further reveal an Alignment-Diversity Tradeoff: using only target-task calibration data can degrade post-quantization performance, whereas incorporating general-domain data stabilizes sensitivity estimation and improves robustness across tasks. Based on these observations, we propose TASA (Task-Aware Sensitivity Analysis), a two-level framework that jointly optimizes calibration-data composition and mixed-precision bit allocation. Specifically, TASA searches for a calibration-data mixture using a training-free gradient-trace alignment criterion, and then aggregates perplexity and reasoning-oriented sensitivity signals to guide both inter-layer and intra-layer bit allocation. Experiments on LLaMA-3-8B and Qwen2.5-7B reveal a precision inversion: appropriately allocated 3.5-bit models can match or surpass less task-aware 4-bit baselines. At an average precision of 3.5 bits, TASA matches or outperforms several competitive 4-bit uniform baselines in aggregate accuracy, and improves over the strongest W3 baseline on GSM8K by more than 20 absolute points on LLaMA-3-8B. These results show that calibration-data composition substantially affects task-sensitive quantization, a factor underexplored in prior work.

  • 6 authors
·
Jun 30

Beyond Perplexity: A Geometric and Spectral Study of Low-Rank Pre-Training

Pre-training large language models is dominated by the memory cost of storing full-rank weights, gradients, and optimizer states. Low-rank pre-training has emerged to address this, and the space of methods has grown rapidly. A central question remains open: do low-rank methods produce models that generalize comparably to full-rank training, or does the rank constraint fundamentally alter the solutions reached? Existing comparisons rely almost entirely on validation perplexity from single-seed runs, often carried forward from prior literature. Yet perplexity is a poor proxy for solution quality; two methods can match on perplexity while converging to different loss landscape regions and internal representations. We close this gap by characterizing the solutions found by five low-rank pre-training methods, GaLore and Fira (memory-efficient optimizers), CoLA and SLTrain (architecture reparameterizations), and ReLoRA (adapter-style updates with periodic resets), against full-rank training at three model scales (60M, 130M, 350M). We evaluate each along 16 metrics across four dimensions: 1-D loss landscape along random/top-K PCA directions, 1-D interpolation between checkpoints, spectral structure of the weights and learned updates, and activation similarity to full-rank training. We show that low-rank methods are not equivalent to full-rank training, nor to one another, even when validation perplexity is close. Full-rank training settles into a sharper basin than low-rank methods along random directions, while the reverse holds for the top-1 PCA direction. Each method converges to a geometrically distinct basin. Low-rank activations diverge from full-rank in later layers as training progresses, with GaLore tracking full-rank most closely. Further, validation perplexity does not translate to downstream performance at every scale. Adding geometric and spectral metrics improves the prediction.

  • 4 authors
·
May 18

Fidelity Is Not Safety: Gently-Compressed LLMs Pass Every Data-Free Quality Guard Yet Invent Procedure Steps in Agentic Execution

Practitioners accept a compressed language model once it clears a stack of data-cheap quality guards: perplexity within a small factor of the original, downstream accuracy (for example MMLU) inside a confidence interval, and data-free output-fidelity signals that compare the compressed and original network's internal representations under random probe inputs. This stack has a blind spot. Across three model families, gently-compressed models clear every guard and then invent procedure steps that were never in the instructions when they run a standard operating procedure (SOP) as an agent. The effect is operator-specific: coherent low-rank (SVD) truncation induces it, and magnitude pruning matched to the same perplexity does not. One dissociation isolates the cause. The same compressed weights that CI-win a paired output-fidelity test CI-fail the invented-step canary. The governing axis is the coherence of the compression error times its rate; the magnitude of the damage does not predict it. The data-free fidelity probe is a fidelity oracle by construction, so it cannot see this axis. We characterize the blindspot and dissociation with paired confidence intervals on a pre-registered, powered canary across three architectures. Operator-specificity replicates on all three, and the perplexity-guard evasion appears where the model admits in-guard low-rank headroom. We then give a data-free screen: a two-axis statistic of the compression error (coherent-fraction and error-rate) that flags the failing builds with fixed thresholds across architectures and matches the coherence-times-rate mechanism. Perplexity, MMLU, and fidelity acceptance do not certify agent safety. Screen gently-compressed low-rank builds before agentic deployment

  • 2 authors
·
Jul 29

Benchmarking Parameter-Efficient Fine-Tuning of Large Language Models for Low-Resource Tajik Text Generation with the Tajik Web Corpus

We release the Tajik Web Corpus (319k docs, 1.11B chars) and benchmark generative LLMs on prompt continuation in Tajik, a low-resource Cyrillic-script language. Seventeen configurations across nine architectures are evaluated under three fine-tuning strategies: full fine-tuning, LoRA, and QLoRA (ranks 8 and 16). Because perplexity is not directly comparable across model families with different tokenizers, generation quality is assessed through perplexity interpreted within each family, complemented by qualitative analysis performed by a native Tajik speaker. Computational cost is measured via GPU memory and training time. The best quality-cost trade-off is achieved by Mistral 7B with QLoRA rank 8: perplexity 5.11 (within its tokenizer family), coherent Tajik output confirmed by the native speaker, 14.21 GB GPU memory, and approximately 33 minutes of training. Increasing the rank to 16 yields a negligible improvement for Mistral (perplexity 5.03, pairwise p > 0.05) while consuming about 1 GB more memory. Full fine-tuning of small GPT-2 models obtains lower numeric perplexity but leads to catastrophic forgetting (English or gibberish output); in contrast, QLoRA preserves multilingual pretrained knowledge and generates meaningful Tajik text. Encoder-only models perform worst (perplexity approximately 59), confirming their unsuitability for autoregressive generation. To our knowledge, this is the first systematic PEFT benchmark for Tajik text generation. Practical recommendations include using Mistral 7B with QLoRA r=8, avoiding full fine-tuning of small GPT-2 models, and adopting the released corpus and benchmark.

  • 1 authors
·
Aug 9

A Theoretical Study on Bridging Internal Probability and Self-Consistency for LLM Reasoning

Test-time scaling seeks to improve the reasoning performance of large language models (LLMs) by adding computational resources. A prevalent approach within the field is sampling-based test-time scaling methods, which enhance reasoning by generating multiple reasoning paths for a given input during inference. However, despite its practical success, the theoretical foundations remain underexplored. In this paper, we provide the first theoretical framework for analyzing sampling-based test-time scaling methods, grounded in the perspective of confidence estimation. Based on the framework, we analyze two dominant paradigms: self-consistency and perplexity, and reveal key limitations: self-consistency suffers from high estimation error while perplexity exhibits substantial modeling error and possible degradation of the estimation error convergence. To address these limitations, we introduce RPC, a hybrid method that leverages our theoretical insights through two key components: Perplexity Consistency and Reasoning Pruning. Perplexity Consistency combines the strengths of self-consistency and perplexity, boosting the convergence rate of estimation error from linear to exponential while preserving model error. Reasoning Pruning prevents degradation by eliminating low-probability reasoning paths. Both theoretical analysis and empirical results across seven benchmark datasets demonstrate that RPC has a strong potential for reducing reasoning error. Notably, RPC achieves reasoning performance comparable to self-consistency while not only enhancing confidence reliability but also reducing sampling costs by 50%. The code and resources are available at https://wnjxyk.github.io/RPC.

LAMDA-NeSy NJU-IRP
·
Oct 17, 2025 7

Excess Separability: Nuisance-Controlled Residual-Stream Probing for Benchmark Contamination Detection

Benchmark contamination is diagnosed with n-gram overlap, likelihood-based membership inference, or canary strings, and each needs something usually unavailable: the training corpus, a well-chosen test statistic, or foresight at release. A recent alternative reads it off a linear probe on internal activations. We show the natural way to do this does not work, specify one that survives measurement, then find that the correction making it work carries more variance than the null it is tested against. The protocol reports a zero-sum contrast on the depth profile of probe accuracy, recentred on a level-matched placebo baseline, tested against a label-permutation null, with the reference set twice the size of the suspect set. Each choice replaces a simpler alternative we rejected on measurement. Reporting the level of excess separability rather than its shape makes the false positive rate track the size of the analyst's own control set, 0.03 to 0.99 under a true null. Contrasting against a flat depth profile rejects a true null 0.72 of the time when surface decodability rises with depth, and loses all power when it falls. On real transformers the protocol fails a test the simulations did not pose. The recentring subtracts an estimate, and the permutation null holds it fixed. Re-estimated across split seeds on four audits of contaminated checkpoints, its standard deviation is 1.30 to 1.56 times the null's own in every arm: what is subtracted to remove a bias is more variable than what it corrects. The one nominally significant result, p = 0.0075, becomes 0.0745 once that variance is propagated, and no verdict is issued. The simulations missed this because their surface key is the covariate driving item variation; on real text it is a proxy, and degrading key quality in simulation reproduces it. We add a companion measurement and a widened null. No arm shows contamination.

  • 1 authors
·
Aug 15

DataMan: Data Manager for Pre-training Large Language Models

The performance emergence of large language models (LLMs) driven by data scaling laws makes the selection of pre-training data increasingly important. However, existing methods rely on limited heuristics and human intuition, lacking comprehensive and clear guidelines. To address this, we are inspired by ``reverse thinking'' -- prompting LLMs to self-identify which criteria benefit its performance. As its pre-training capabilities are related to perplexity (PPL), we derive 14 quality criteria from the causes of text perplexity anomalies and introduce 15 common application domains to support domain mixing. In this paper, we train a Data Manager (DataMan) to learn quality ratings and domain recognition from pointwise rating, and use it to annotate a 447B token pre-training corpus with 14 quality ratings and domain type. Our experiments validate our approach, using DataMan to select 30B tokens to train a 1.3B-parameter language model, demonstrating significant improvements in in-context learning (ICL), perplexity, and instruction-following ability over the state-of-the-art baseline. The best-performing model, based on the Overall Score l=5 surpasses a model trained with 50% more data using uniform sampling. We continue pre-training with high-rated, domain-specific data annotated by DataMan to enhance domain-specific ICL performance and thus verify DataMan's domain mixing ability. Our findings emphasize the importance of quality ranking, the complementary nature of quality criteria, and their low correlation with perplexity, analyzing misalignment between PPL and ICL performance. We also thoroughly analyzed our pre-training dataset, examining its composition, the distribution of quality ratings, and the original document sources.

  • 6 authors
·
Feb 26, 2025

Bridging Internal Probability and Self-Consistency for Effective and Efficient LLM Reasoning

Recent advancements in large language models (LLMs) have demonstrated remarkable reasoning capabilities. However, single-shot inference often yields unreliable results for complex reasoning tasks, leading researchers to explore multiple reasoning paths through methods such as perplexity and self-consistency. In this paper, we present the first theoretical error decomposition analysis of these techniques, breaking down their error into estimation error and model error. Our analysis reveals a fundamental trade-off: perplexity methods suffer from substantial model error due to the absence of a proper consistency function, while self-consistency exhibits high estimation error due to a slow error convergence rate. To overcome these limitations, we propose Reasoning-Pruning Perplexity Consistency (RPC). This approach combines Perplexity Consistency, which seamlessly integrates LLM perplexity with self-consistency, and Reasoning Pruning, which eliminates low-probability reasoning paths to effectively prevent the degeneration of estimation error reduction. Theoretical analysis demonstrates that RPC not only accelerates the convergence rate of estimation error to an exponential level but also holds strong potential for further reducing model error. Extensive empirical evaluations on seven benchmark datasets confirm that RPC can significantly improve reasoning performance, sample efficiency, and confidence reliability.

  • 7 authors
·
Feb 1, 2025

The Butterfly Effect of Model Editing: Few Edits Can Trigger Large Language Models Collapse

Although model editing has shown promise in revising knowledge in Large Language Models (LLMs), its impact on the inherent capabilities of LLMs is often overlooked. In this work, we reveal a critical phenomenon: even a single edit can trigger model collapse, manifesting as significant performance degradation in various benchmark tasks. However, benchmarking LLMs after each edit, while necessary to prevent such collapses, is impractically time-consuming and resource-intensive. To mitigate this, we propose using perplexity as a surrogate metric, validated by extensive experiments demonstrating changes in an edited model's perplexity are strongly correlated with its downstream task performances. We further conduct an in-depth study on sequential editing, a practical setting for real-world scenarios, across various editing methods and LLMs, focusing on hard cases from our previous single edit studies. The results indicate that nearly all examined editing methods result in model collapse after only few edits. To facilitate further research, we have utilized GPT-3.5 to develop a new dataset, HardEdit, based on those hard cases. This dataset aims to establish the foundation for pioneering research in reliable model editing and the mechanisms underlying editing-induced model collapse. We hope this work can draw the community's attention to the potential risks inherent in model editing practices.

  • 6 authors
·
Feb 14, 2024

Position Bias is Hidden Behind Ceiling Effects: A Permutation Diagnostic for LLM Benchmarks

Position bias in multiple-choice LLM evaluation is widely cited as a confound in capability comparisons, but published measurements rely on single answer-order shuffles whose results confound the bias signal with content-level noise and sampling stochasticity. I introduce inspect_permute, an open-source extension to the inspect_ai evaluation framework that runs exhaustive answer-order permutations per question and reports the chi-squared / Cramer V signature of position bias with bootstrap confidence intervals. I apply the tool across four vendors (gpt-4o-mini, claude-haiku-4-5, gemini-2.5-flash, grok-3) on five MMLU subjects, 24,000 API calls under temperature-0 generation, with falsifier predictions pre-registered via a public SHA-256 hash before half the data was observed. Position bias turns out to be statistically detectable only within a roughly 60-95% base-accuracy Goldilocks zone. Below it, processing-load dominance swamps subject-specific signal; above it, ceiling effects compress the variance below the chi-squared test resolution. Detectable cells separate into two mechanism types: monotone A-to-D decrease (processing_load, in low-tier models) and non-monotone D-drop (content_ambiguity, in a narrow capability band). Standard MMLU places every frontier-tier model above the detection band, so absence of signal there should be read as not measurable, not unbiased. Together with the ceiling-effect characterisation in arXiv:2606.26185, this work brackets the detectable region of position-bias measurement and makes the field central question askable in a verifiable form. Package, data, preregistration under MIT.

  • 1 authors
·
Jul 22

When Load-Balancing Goes Too Far: Expert Pruning in Over-Dispersed Mixture-of-Experts Models

Expert pruning reduces the memory and serving cost of Mixture-of-Experts (MoE) models by removing low-importance experts identified by the router, assuming router probabilities provide a reliable importance signal. We observe that this assumption breaks down under over-dispersed routing, a regime associated with aggressive load-balancing during training, in which tokens are distributed nearly uniformly across experts and importance signals collapse. In this regime, perplexity does not predict downstream task accuracy: on gpt-oss-20B, the lowest-perplexity pruning configuration yields the worst mathematical reasoning, while the highest-perplexity configuration preserves it. This does not occur under standard routing (e.g., Mixtral-8x7B-Instruct), where perplexity and accuracy degrade together. Pruning under over-dispersed routing also exposes a capability trade-off in which no single scoring metric dominates: activation-aware scoring preserves mathematical reasoning but severely degrades knowledge-intensive science (an 18-point gap on GPQA), whereas frequency-based scoring exhibits the reverse. We propose Minimax Expert Score Allocation (MESA), a domain-aware method that iteratively boosts importance scores for experts serving whichever domain is currently worst-affected, minimizing worst-case domain degradation rather than average accuracy. At 25% expert pruning MESA achieves the smallest worst-case degradation across domains, outperforming activation-aware baselines on 7 of 11 benchmarks at a correspondingly reduced memory footprint, and it generalizes to gpt-oss-120B, Gemma-4-26B-A4B, and OLMoE-1B-7B. Our results indicate that over-dispersed routing is a qualitatively distinct pruning regime in which standard assumptions fail, and that recognizing it is a prerequisite for principled expert pruning of load-balanced MoE models.

  • 7 authors
·
Sep 2

Why Gated DeltaNet Survives 4-Bit Quantization: NVFP4 W4A4 for the Recurrent Half of a Hybrid 27B LLM

Hybrid LLMs pair softmax attention with linear-attention layers such as Gated DeltaNet (GDN), whose recurrent state summarizes the context in fixed size. Early community 4-bit quantizations of Qwen3.8-27B (48 GDN layers, 16 attention layers) left the GDN block in 8- or 16-bit precision -- especially its decay and write-strength gates -- on the intuition that errors in a recurrence accumulate over long contexts. We test that intuition by building Minima: NVFP4 W4A4 on all 496 linear layers, GDN included. Across perplexity at 4K/32K, MMLU-Pro, GSM8K, AIME'25, GPQA-Diamond, LiveCodeBench, and RULER retrieval to 64K, Minima matches BF16 within seed noise (5-task average -0.52) while being the smallest (17.5 GiB) and fastest-prefill (+14-19%) recipe we compare, and its 32K perplexity gap shrinks with position. A four-part mechanism study explains why: (i) NVFP4's 16-element block scaling localizes the residual stream's extreme outliers, equalizing activation error across layer roles; (ii) the supposedly fragile gate projections are the least sensitive -- softplus/exponential and sigmoid parameterizations compress ~11% GEMM error to ~2% output error; (iii) the delta-rule recurrence holds injected noise at a flat plateau over 32K tokens and forgets a state impulse within hundreds of steps, because each write overwrites the state along the current key direction; (iv) the per-token quantization cost washes out with context instead of compounding. We also repair a global-scale mismatch that arises when per-module-calibrated NVFP4 checkpoints are served by kernels that fuse those modules into one GEMM, and show calibrated FP8 KV-cache scales are performance-free. The result: a practical recipe -- quantize everything, ship KV scales -- and a mechanistic account of why the recurrent half of a hybrid LLM is the easy half to quantize. Checkpoint: https://huggingface.co/minima-ai/mnma_qwen3.8_27b_nvfp4

minima-ai Minima AI
·
Sep 2 2

OPERA: Aligning Open-Ended Reasoning via Objective Perplexity-based Reinforcement Learning

Reinforcement Learning (RL) has enabled LLMs to excel in objective reasoning tasks such as mathematics and code generation. However, applying RL to open-ended tasks, such as creative writing, remains challenging because LLM-as-a-judge reward models often exhibit stylistic biases and positional inconsistencies, leading to unstable supervision. To address this, we propose OPERA (Objective Perplexity-based Reflective Alignment), which replaces unreliable external judges with intrinsic rewards derived from perplexity dynamics. Specifically, we derive an intrinsic reward signal from perplexity dynamics, quantifying uncertainty reduction at critical reflective states. During the cold-start phase, we introduce a data synthesis method that leverages carefully designed guiding words to generate diverse reasoning traces, along with perplexity-prioritized rollouts that utilize internal log-probabilities to identify logically consistent reasoning branches. This pipeline yields a large-scale dataset comprising 20,000 high-quality reasoning trajectories. Empirical evaluations consistently demonstrate the scalability and efficacy of our approach in alignment for open-ended tasks. Implementing OPERA on Qwen3-8B establishes a new state-of-the-art among open-source models, achieving parity with or surpassing proprietary models like Gemini2.5 and MiniMax-M2.5 in some open-ended tasks. The code is available at https://github.com/pangpang-xuan/OPERA.

  • 9 authors
·
Jun 23

Protecting Copyrighted Material with Unique Identifiers in Large Language Model Training

A primary concern regarding training large language models (LLMs) is whether they abuse copyrighted online text. With the increasing training data scale and the prevalence of LLMs in daily lives, two problems arise: 1) false positive membership inference results misled by similar examples; 2) membership inference methods are usually too complex for end users to understand and use. To address these issues, we propose an alternative insert-and-detect methodology, advocating that web users and content platforms employ \textit{unique identifiers} for reliable and independent membership inference. Users and platforms can create their identifiers, embed them in copyrighted text, and independently detect them in future LLMs. As an initial demonstration, we introduce \textbf{ghost sentences} and a user-friendly last-k words test, allowing end users to chat with LLMs for membership inference. Ghost sentences consist primarily of unique passphrases of random natural words, which can come with customized elements to bypass possible filter rules. The last-k words test requires a significant repetition time of ghost sentences~(ge10). For cases with fewer repetitions, we designed an extra perplexity test, as LLMs exhibit high perplexity when encountering unnatural passphrases. We also conduct a comprehensive study on the memorization and membership inference of ghost sentences, examining factors such as training data scales, model sizes, repetition times, insertion positions, wordlist of passphrases, alignment, etc. Our study shows the possibility of applying ghost sentences in real scenarios and provides instructions for the potential application.

  • 4 authors
·
Mar 23, 2024

Queries, Representation & Detection: The Next 100 Model Fingerprinting Schemes

The deployment of machine learning models in operational contexts represents a significant investment for any organisation. Consequently, the risk of these models being misappropriated by competitors needs to be addressed. In recent years, numerous proposals have been put forth to detect instances of model stealing. However, these proposals operate under implicit and disparate data and model access assumptions; as a consequence, it remains unclear how they can be effectively compared to one another. Our evaluation shows that a simple baseline that we introduce performs on par with existing state-of-the-art fingerprints, which, on the other hand, are much more complex. To uncover the reasons behind this intriguing result, this paper introduces a systematic approach to both the creation of model fingerprinting schemes and their evaluation benchmarks. By dividing model fingerprinting into three core components -- Query, Representation and Detection (QuRD) -- we are able to identify sim100 previously unexplored QuRD combinations and gain insights into their performance. Finally, we introduce a set of metrics to compare and guide the creation of more representative model stealing detection benchmarks. Our approach reveals the need for more challenging benchmarks and a sound comparison with baselines. To foster the creation of new fingerprinting schemes and benchmarks, we open-source our fingerprinting toolbox.

  • 5 authors
·
Dec 17, 2024

(Dynamic) Prompting might be all you need to repair Compressed LLMs

Large language models (LLMs), while transformative for NLP, come with significant computational demands, underlining the need for efficient, training-free compression. Notably, the reliability of perplexity as a benchmark for compressed model efficacy is in question, as our tests using LLaMA-7B and OPT-6.7b reveal a significant performance drop in several realistic downstream tasks, underscoring the disparity between perplexity as a performance indicator and real-world performance. Investigation into the trade-off between resource-intensive post-compression re-training highlights the prospect of prompt-driven recovery as a lightweight adaption tool. However, existing studies, confined mainly to perplexity evaluations and simple tasks, fail to offer unequivocal confidence in the scalability and generalizability of prompting. We tackle this uncertainty in two key ways. First, we uncover the vulnerability of naive prompts in LLM compression as an over-reliance on a singular prompt per input. In response, we propose inference-time dynamic prompting (IDP), a mechanism that autonomously chooses from a set of curated prompts based on the context of each individual input. Second, we delve into a scientific understanding of why ``prompting might be all you need post-LLM compression". Our findings suggest that compression doesn't irretrievably erase LLM model knowledge but displace it, necessitating a new inference path. IDP effectively redirects this path, enabling the model to tap into its inherent yet displaced knowledge and thereby recover performance. Empirical tests affirm the value of IDP, demonstrating an average performance improvement of 1.24% across nine varied tasks spanning multiple knowledge domains.

  • 5 authors
·
Oct 1, 2023

Evaluating the Robustness of Proof Autoformalization in Lean 4

Proof autoformalization aims to translate a mathematical informal proof written in natural language into a formal proof in a formal language such as Lean~4. Several works have developed LLM-based models for proof autoformalization. However, existing evaluations have typically focused on translating well-formed informal proofs from curated datasets. We argue that a robust proof autoformalizer must remain faithful even for informal proofs that diverge from these idealized ones, and we present the first study on the robustness of proof autoformalization models. We formulate two categories of perturbations and evaluate robustness under each: a global perturbation paraphrases the informal proof in a different style, under which the formalization should remain consistent; a local perturbation alters a value, symbol, or proof step, possibly in a counterfactual way, and a robust formalization should faithfully reflect the perturbation rather than reverting to the original one or inferring a different one on its own. We build a benchmark with both perturbations on miniF2F and MATH-500, and automatically measure how stable a proof autoformalization's correctness is under global perturbations and how faithfully its output reflects local perturbations. We evaluate seven recent models, all of which are sensitive to global perturbations and mostly fail to remain faithful under local perturbations. Code and data are available via https://github.com/ucr-rai/robust-proof-autoformalization.

  • 3 authors
·
Jun 11

The Faithfulness Gap: Certifying Semantic Equivalence Between Natural-Language and Formal Mathematical Statements

Autoformalization, translating natural-language mathematics into formal proof assistants, is bottlenecked not by translation fluency but by faithfulness: a formal statement can typecheck and be provable, yet still encode a different theorem than the source intended. We introduce Bidirectional Provability Fingerprinting (), a framework that certifies faithfulness by characterizing each candidate through its forward and backward consequence neighborhoods in the ambient theory and matching these against probes derived from the natural-language statement. We further introduce four novel components: (i) Counterfactual Probe Generation (), a contrastive procedure that synthesizes probes targeting specific drift directions; (ii) the Equivalence Spectrum, a continuous faithfulness score that replaces brittle binary verdicts; (iii) Adaptive Probe Budget Allocation (), an information-theoretic budget router; and (iv) Faithfulness-Guided Decoding (), which uses signals as a reward during autoformalization. We prove a drift detection theorem and a PAC-faithfulness result establishing that the equivalence class of a natural language statement is learnable from O(log(1/δ)/varepsilon) probes under mild assumptions. We release , a benchmark of 2{,}183 NL/Lean~4 pairs with controlled drift labels across six subfields of mathlib4. \,+\, detects 89.6% of drifted formalizations at a 3.0% false-positive rate-against 41.2% for typecheck and 63.3% for LLM-judge baselines, and reduces the rate at which a state-of-the-art autoformalizer emits drifted statements by 47%. https://pmlrbd.github.io/BPF/

  • 2 authors
·
Jun 14

Witnessd: Proof-of-process via Adversarial Collapse

Digital signatures prove key possession, not authorship. An author who generates text with AI, constructs intermediate document states post-hoc, and signs each hash produces a signature chain indistinguishable from genuine composition. We address this gap between cryptographic integrity and process provenance. We introduce proof-of-process, a primitive category for evidence that a physical process, not merely a signing key, produced a digital artifact. Our construction, the jitter seal, injects imperceptible microsecond delays derived via HMAC from a session secret, keystroke ordinal, and cumulative document hash. Valid evidence requires that real keystrokes produced the document through those intermediate states. We propose the Adversarial Collapse Principle as an evaluation criterion: evidence systems should be judged by whether disputing them requires a conjunction of specific, testable allegations against components with independent trust assumptions. We present Witnessd, an architecture combining jitter seals with Verifiable Delay Functions, external timestamp anchors, dual-source keystroke validation, and optional hardware attestation. Each layer forces allegations at different capability levels; disputing authentic evidence requires coordinated claims across independent trust boundaries. The system does not prevent forgery: a kernel-level adversary can defeat it, and typing AI-generated content produces valid evidence. The contribution is converting vague doubt into falsifiable allegations. We evaluate across 31,000 verification trials with deterministic rejection of invalid proofs.

  • 1 authors
·
Feb 1

Weight Pruning Amplifies Bias: A Multi-Method Study of Compressed LLMs for Edge AI

Weight pruning is widely advocated for deploying Large Language Models on resource-constrained IoT and edge devices, yet its impact on model fairness remains poorly understood. We conduct a controlled empirical study of three instruction-tuned models (Gemma-2-9b-it, Mistral-7B-Instruct-v0.3, Phi-3.5-mini-instruct) across three pruning methods (Random, Magnitude, Wanda) at four sparsity levels (10-70%) on 12,148 BBQ bias benchmark items with 5 random seeds, totaling 2,368,860 inference records. Our results reveal a Smart Pruning Paradox: activation-aware pruning (Wanda) preserves perplexity nearly perfectly (just 3.5% increase at 50% sparsity for Mistral-7B), yet produces the highest bias amplification, with Stereotype Reliance Score increasing 83.7% and 47-59% of previously unbiased items developing new stereotypical behaviors at 70% sparsity. Random pruning destroys language capability entirely (perplexity exceeding 10^4 and reaching 10^8) but produces only random-chance bias. We further show that unstructured pruning provides zero storage savings and zero inference latency reduction on real edge hardware, undermining the primary motivation for its use in IoT deployment. Of 180 dense-vs-pruned comparisons, 141 (78.3%) are significant (p < 0.05) with mean |h| = 0.305. Published quantization studies report up to 21% of responses flipping between biased and unbiased states; our pruning results show transition rates nearly three times higher (47-59%), suggesting pruning poses a categorically greater risk to alignment than quantization. These findings demonstrate that perplexity-based evaluation provides false assurance of behavioral equivalence, and that IoT deployment pipelines require bias-aware validation before deploying pruned models at the edge.

  • 2 authors
·
May 1

Judging LLMs on a Simplex

Automated evaluation of free-form outputs from large language models (LLMs) is challenging because many distinct answers can be equally valid. A common practice is to use LLMs themselves as judges, but the theoretical properties of this approach are not yet well understood. We show that a geometric framework that represents both judges and candidates as points on a probability simplex can provide helpful insight on what is or is not identifiable using LLM judges. Our theoretical analysis uncovers a "phase transition" in ranking identifiability: for binary scoring systems, true rankings are identifiable even with weak judges under mild assumptions, while rankings become non-identifiable for three or more scoring levels even with infinite data, absent additional prior knowledge. This non-identifiability highlights how uncertainty in rankings stems from not only aleatoric uncertainty (i.e., inherent stochasticity in the data) but also epistemic uncertainty regarding which assumptions hold, an aspect that has received limited attention until now. To integrate both types of uncertainty, we use Bayesian inference to encode assumptions as priors and conduct sensitivity analysis of ranking estimates and credible intervals. Empirical evaluations across multiple benchmarks demonstrate that Bayesian inference yields more accurate rankings and substantially improves coverage rates. These results underscore the importance of taking a more holistic approach to uncertainty quantification when using LLMs as judges.

  • 4 authors
·
May 28, 2025

Uniformly Stable Minimal Weyl--Heisenberg Measurements Approaching the SIC Benchmark

Informational completeness (IC) guarantees that an inverse exists, not that it is statistically well conditioned. For minimal rank-one Weyl--Heisenberg (WH) measurements, covariance makes the nonidentity projector-Gram spectrum proportional to the fiducial's ambiguity intensities, with eigenvalues \(d|χ_ϕ(u)|^2\), turning stability into an explicit worst-direction design problem; write \(λ\) for its smallest nonidentity eigenvalue. Haar fiducials are IC almost surely while \(\mathbb E[λ^{-1}]=\infty\), and an explicit geometric family used to establish balanced informationally complete measurements in every dimension has a normalized spectral floor bounded above by an exponentially decaying envelope. We then construct a hierarchy of minimal measurements. A cyclic family with exactly \(d^2\) outcomes in every integer dimension has floors \(Θ(d^{-3})\) for odd \(d\) and \(Θ(d^{-5})\) for even \(d\); a finite-field family for \(q=2^m\) obeys the uniform bound \(λ\ge4/9\). Our main result treats every prime-power dimension of characteristic \(p\ge5\). A balanced one-coordinate perturbation repairs the zero ambiguity axis of a cubic Alltop state, gives an attained floor uniformly bounded below by a positive constant, and confines the entire nonidentity spectrum to \([L_q,U_q]\) with \(U_q/L_q\to1\). Its SIC-normalized minimum tends to one, and \(λ(ϕ_q)/Λ_q^\star\to1\) for the global finite-field WH max--min optimum \(Λ_q^\star\), without assuming SIC existence. The complete spectrum determines the exact finite-sample Hilbert--Schmidt error of canonical linear inversion at \(I/d\), while its lower edge controls local Fisher efficiency and canonical-shadow bounds.

  • 2 authors
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Aug 11

Internal Knowledge Without External Expression: Probing the Generalization Boundary of a Classical Chinese Language Model

We train a 318M-parameter Transformer language model from scratch on a curated corpus of 1.56 billion tokens of pure Classical Chinese, with zero English characters or Arabic numerals. Through systematic out-of-distribution (OOD) testing, we investigate whether the model can distinguish known from unknown inputs, and crucially, whether it can express this distinction in its generated text. We find a clear dissociation between internal and external uncertainty. Internally, the model exhibits a perplexity jump ratio of 2.39x between real and fabricated historical events (p = 8.9e-11, n = 92 per group), with semi-fabricated events (real figures + fictional events) showing the highest perplexity (4.24x, p = 1.1e-16), demonstrating genuine factual encoding beyond syntactic pattern matching. Externally, however, the model never learns to express uncertainty: classical Chinese epistemic markers appear at lower rates for OOD questions (3.5%) than for in-distribution questions (8.3%, p = 0.023), reflecting rhetorical conventions rather than genuine metacognition. We replicate both findings across three languages (Classical Chinese, English, Japanese), three writing systems, and eight models from 110M to 1.56B parameters. We further show that uncertainty expression frequency is determined entirely by training data conventions, with Classical Chinese models showing a "humility paradox" (more hedging for known topics), while Japanese models almost never hedge. We argue that metacognitive expression -- the ability to say "I don't know" -- does not emerge from language modeling alone and requires explicit training signals such as RLHF.

  • 7 authors
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Mar 30

Does Bielik Know What It Doesn't Know? Activation Dispersion Separates Entity Familiarity from Factual Reliability Across Model Scale

Large language models hallucinate most about entities they have never seen. We ask whether a model's activations betray entity familiarity before a single answer token is generated, and whether that signal predicts the factual reliability of the answers. On four Polish Bielik models (1.5B-11B parameters), we probe four entity domains (athletes, cities, writers, musicians), each with 42 well-known, 42 obscure-but-real, and 42 fabricated entities addressed by a one-sentence question (504 prompts per model). Two unsupervised, single-forward-pass dispersion measures over post-SwiGLU MLP activations, inverse participation ratio and spectral entropy, separate known from fabricated entities at AUROC 0.95-1.00 across all domains and scales; a supervised linear probe reaches 0.99-1.00. Both clear selection-aware permutation floors of about 0.70-0.74 (empirical p<=1e-3), survive held-out layer selection (0.93-0.99), and persist on real names (known vs. obscure-but-real: 0.96-1.00). The signal transfers across entity types (mean off-diagonal AUROC 0.92-0.99); a matched-template counterfactual shows the only large drops are template-caused, not entity-type effects, and the signal is diffuse across heads. This representational signal is already at ceiling at 1.5B, whereas behavioral factual reliability scales sharply: 0, 2, 10, and 19 of 42 known athletes are answered fully correctly by the 1.5B, 4.5B, 7B, and 11B models under a strict judge. Within known entities, separating correct from hallucinated answers is much harder (probe 0.93; dispersion no better than a first-token-entropy baseline). A five-sample semantic-entropy baseline reaches only 0.71-0.83 at 5x the inference cost. Despite this internal awareness, the models almost never abstain: an audit of 2,520 answers finds 2 refusals and 1 hedge. Entity familiarity and factual reliability are distinct phenomena on different scaling curves.

  • 1 authors
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Jul 7

Real Money, Fake Models: Deceptive Model Claims in Shadow APIs

Access to frontier large language models (LLMs), such as GPT-5 and Gemini-2.5, is often hindered by high pricing, payment barriers, and regional restrictions. These limitations drive the proliferation of shadow APIs, third-party services that claim to provide access to official model services without regional limitations via indirect access. Despite their widespread use, it remains unclear whether shadow APIs deliver outputs consistent with those of the official APIs, raising concerns about the reliability of downstream applications and the validity of research findings that depend on them. In this paper, we present the first systematic audit between official LLM APIs and corresponding shadow APIs. We first identify 17 shadow APIs that have been utilized in 187 academic papers, with the most popular one reaching 5,966 citations and 58,639 GitHub stars by December 6, 2025. Through multidimensional auditing of three representative shadow APIs across utility, safety, and model verification, we uncover both indirect and direct evidence of deception practices in shadow APIs. Specifically, we reveal performance divergence reaching up to 47.21%, significant unpredictability in safety behaviors, and identity verification failures in 45.83% of fingerprint tests. These deceptive practices critically undermine the reproducibility and validity of scientific research, harm the interests of shadow API users, and damage the reputation of official model providers.

  • 6 authors
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Mar 2 1

WOUAF: Weight Modulation for User Attribution and Fingerprinting in Text-to-Image Diffusion Models

The rapid advancement of generative models, facilitating the creation of hyper-realistic images from textual descriptions, has concurrently escalated critical societal concerns such as misinformation. Traditional fake detection mechanisms, although providing some mitigation, fall short in attributing responsibility for the malicious use of synthetic images. This paper introduces a novel approach to model fingerprinting that assigns responsibility for the generated images, thereby serving as a potential countermeasure to model misuse. Our method modifies generative models based on each user's unique digital fingerprint, imprinting a unique identifier onto the resultant content that can be traced back to the user. This approach, incorporating fine-tuning into Text-to-Image (T2I) tasks using the Stable Diffusion Model, demonstrates near-perfect attribution accuracy with a minimal impact on output quality. We rigorously scrutinize our method's secrecy under two distinct scenarios: one where a malicious user attempts to detect the fingerprint, and another where a user possesses a comprehensive understanding of our method. We also evaluate the robustness of our approach against various image post-processing manipulations typically executed by end-users. Through extensive evaluation of the Stable Diffusion models, our method presents a promising and novel avenue for accountable model distribution and responsible use.

  • 5 authors
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Jun 7, 2023 1

RidgeBase: A Cross-Sensor Multi-Finger Contactless Fingerprint Dataset

Contactless fingerprint matching using smartphone cameras can alleviate major challenges of traditional fingerprint systems including hygienic acquisition, portability and presentation attacks. However, development of practical and robust contactless fingerprint matching techniques is constrained by the limited availability of large scale real-world datasets. To motivate further advances in contactless fingerprint matching across sensors, we introduce the RidgeBase benchmark dataset. RidgeBase consists of more than 15,000 contactless and contact-based fingerprint image pairs acquired from 88 individuals under different background and lighting conditions using two smartphone cameras and one flatbed contact sensor. Unlike existing datasets, RidgeBase is designed to promote research under different matching scenarios that include Single Finger Matching and Multi-Finger Matching for both contactless- to-contactless (CL2CL) and contact-to-contactless (C2CL) verification and identification. Furthermore, due to the high intra-sample variance in contactless fingerprints belonging to the same finger, we propose a set-based matching protocol inspired by the advances in facial recognition datasets. This protocol is specifically designed for pragmatic contactless fingerprint matching that can account for variances in focus, polarity and finger-angles. We report qualitative and quantitative baseline results for different protocols using a COTS fingerprint matcher (Verifinger) and a Deep CNN based approach on the RidgeBase dataset. The dataset can be downloaded here: https://www.buffalo.edu/cubs/research/datasets/ridgebase-benchmark-dataset.html

  • 5 authors
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Jul 9, 2023

Quantization Undoes Alignment: Bias Emergence in Compressed LLMs Across Models and Precision Levels

Large Language Models are routinely compressed via post-training quantization to reduce inference costs and memory footprint for cloud and edge deployment, yet the impact of this compression on model quality remains poorly understood. Existing studies typically compare only two conditions (full-precision vs. a single quantized variant), rely on aggregate bias metrics, and evaluate a single model family, making it impossible to distinguish gradual degradation from threshold-dependent safety failures. We conduct a controlled empirical study of three instruction-tuned models (Qwen2.5-7B, Mistral-7B, Phi-3.5-mini) at five precision levels (BF16 through 3-bit) on 12,148 BBQ bias benchmark items across 5 random seeds, totaling 911,100 inference records. Our results reveal that 3-bit quantization causes 6-21% of previously unbiased items to develop new stereotypical behaviors, following a clear dose-response pattern confirmed via logistic regression, while models' willingness to select "unknown" answers declines by 17.4%. Crucially, these item-level changes are invisible to standard quality metrics: perplexity increases by less than 0.5% at 8-bit and under 3% at 4-bit across all three models, yet 2.5-5.6% of items already develop new biases at 4-bit. These findings demonstrate that aggregate evaluation metrics systematically miss fairness-critical degradation, underscoring the need for quality-aware compression protocols that explicitly test for bias emergence before deployment.

  • 2 authors
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May 1

Pressure-Testing Deception Probes in LLMs: Scaling, Robustness, and the Geometry of Deceptive Representations

Linear probes trained on LLM activations are increasingly proposed as deception-detection metrics, yet report AUROC exceeding 0.96 on clean benchmarks while collapsing under distributional shift. This paper systematically pressure-tests probe-based metrics across the Gemma 3 model family (1B-27B parameters), diagnosing why they fail rather than merely documenting that they fail. We test four hypotheses about deception encoding: (1) single linear direction, (2) multi-dimensional subspace, (3) convex conic hull, (4) entropy proxy. Our design includes cross-domain transfer matrices, multi-dimensional probe analysis with permutation null baselines, entropy-residualization tests, and distractor evaluations across 8 stylistic shifts. We find that: (a) probes achieve near-perfect AUROC (>=0.998) on clean data but collapse under stylistic shifts; style-augmented probes recover near-perfect detection (mean AUROC 0.979-0.983) on unseen styles; (b) the single-direction hypothesis is rejected (k=1 captures only 0.61-0.80 AUROC), with cross-domain transfer failure confirmed as geometric rather than layer-mismatch-driven; (c) the entropy-proxy hypothesis is rejected (max |rho|=0.454, max Delta-AUROC after residualization=0.004); and (d) deception does not form a significant linear subspace (per-domain k*=0), yet multi-dimensional probes (k>=5) recover the signal through distributed sub-threshold features. Probe fragility reflects distributional narrowness rather than an architectural limitation: style-augmented probes recover near-perfect detection at both 4B and 27B, establishing that the inverse scaling pattern is a training-distribution artifact rather than a genuine scale-dependent phenomenon.

  • 1 authors
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May 27 2

Scalable Data Ablation Approximations for Language Models through Modular Training and Merging

Training data compositions for Large Language Models (LLMs) can significantly affect their downstream performance. However, a thorough data ablation study exploring large sets of candidate data mixtures is typically prohibitively expensive since the full effect is seen only after training the models; this can lead practitioners to settle for sub-optimal data mixtures. We propose an efficient method for approximating data ablations which trains individual models on subsets of a training corpus and reuses them across evaluations of combinations of subsets. In continued pre-training experiments, we find that, given an arbitrary evaluation set, the perplexity score of a single model trained on a candidate set of data is strongly correlated with perplexity scores of parameter averages of models trained on distinct partitions of that data. From this finding, we posit that researchers and practitioners can conduct inexpensive simulations of data ablations by maintaining a pool of models that were each trained on partitions of a large training corpus, and assessing candidate data mixtures by evaluating parameter averages of combinations of these models. This approach allows for substantial improvements in amortized training efficiency -- scaling only linearly with respect to new data -- by enabling reuse of previous training computation, opening new avenues for improving model performance through rigorous, incremental data assessment and mixing.

  • 7 authors
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Oct 21, 2024

A JoLT for the KV cache: Near-lossless KV cache compression via joint Lagrangian allocation of Tucker ranks and a rotated residual for llms

The key-value (KV) cache has become the dominant memory cost of transformer inference: it grows with batch size, context length, and depth, and at long context it, rather than the model weights, sets the throughput ceiling. Existing reductions fall into two families. Low-rank methods factor two-dimensional slices of the cache, either per-head matrices or cross-layer feature blocks, and quantization methods lower the bit-width of every entry. Neither exploits the fact that the cache at a layer is naturally a third-order tensor whose three axes, the heads, the tokens, and the features, carry very different amounts of redundancy. We take this tensor view directly. Our method, JoLT (Joint Lagrangian Tucker), applies a partial Tucker decomposition that compresses only the token and feature axes while leaving the head and layer axes intact, then restores the energy that truncation discards with a rotated low-bit residual: a random orthogonal rotation followed by low-bit quantization. A single Lagrangian dual allocates the Tucker ranks and the residual bit-widths together, per layer group and separately for keys and values, under one byte budget. The result is a near-lossless 2-3x compression. Perplexity stays near-lossless on both a grouped-query-attention model (Mistral-7B-v0.3) and a multi-head-attention model (LLaMA-2-13B), and GSM8K accuracy and needle-in-a-haystack retrieval hold at the uncompressed baseline at 2x on both architectures and through 3x on the GQA model. At 2x, JoLT reconstructs the cache to relative Frobenius error 0.009 (K) and 0.006 (V) on both architectures. A randomized-SVD variant, FlashJoLT, delivers a 5-13x compression-time speedup at 1024-token context and matched quality.

  • 2 authors
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Jul 14

Tied Trit-Planes: Constraining PTQTP to a Uniform Nine-Level Quantizer, with a Persistent Folded Format for Disk-Streamed Mixture-of-Experts Serving

PTQTP decomposes LLM weight matrices into two ternary (trit) planes with two free per-group scales. Tying the scales to a fixed ratio of three collapses the decomposition into a single uniform nine-level quantizer, a known balanced-ternary identity. To our knowledge, at the time of writing, this work is the first to impose that identity as a constraint inside PTQTP's solver. The two trit planes then fold losslessly into one 4-bit code plane that we make the persistent serving representation: disk bytes, expert-cache bytes, and kernel input are the same 4.0625-bits/weight blocks, consumed in one integer dot pass. For this conjunction (ratio-3 nine-level code, CPU-SIMD kernels, SSD expert streaming, identical persistent bytes) we likewise found no precedent. We apply this to the routed experts of DeepSeek-V4-Flash-0731, a 284B-A13B mixture-of-experts model, quantizing in one shot from the released MXFP4 expert weights and streaming experts from SSD on a 64 GB laptop. Against a 4.5-bit Q4_K baseline, measured one process per fixture with an expert-lossless anchor arm as reference control, the tied model matches the official serving API on 5/5 fixtures at step 0 (Q4_K: 4/5) and 12/14 captured continuation steps (11/14), scores 86 vs. 84 on a 100-item MMLU subset, decodes 6.7% faster in decode phase, and ships 9% smaller files: no detected fidelity difference at these small evaluation sizes, and every fixture-level difference between the arms traces to a single measured near-tie cell. The tied fit nevertheless shows higher weight-reconstruction error and worse perplexity, a measured dissociation between proxy metrics and reference fidelity. A cumulative trunk-ternarization ladder and bitwise-pinned aarch64/x86-64 kernels complete the report. All code, formats, and evaluation artifacts are open source in the fucina inference stack.

  • 1 authors
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Aug 8

Half the Experts, All the Code: One-Shot Domain Pruning of Mixture-of-Experts LLMs for Coding

The strongest open-weight coding models are mixture-of-experts (MoE) networks: most of their size comes from large pools of "expert" subnetworks, of which only a few act on any token. That pool is why these models do not fit on the machines most developers own, yet for a user who only wants coding help, most experts encode abilities that will never be invoked. We ask how many experts can be removed, and which, by pruning two recent open-weight MoE models from different families (Qwen3.6-35B-A3B and Gemma-4-26B-A4B) under five selection strategies, judged the way a user would: by whether the model still writes correct code. Half the experts can be removed from either model with no statistically detectable loss on the primary code benchmark, and the damage lands almost entirely on abilities outside coding, the intended trade. But the winning strategy flips between the two models, so a recipe validated on one family cannot be assumed to work on another. We further show that perplexity, the metric much of the pruning literature leans on, can rate a broken model above an intact one; that a lightweight fine-tune recovers about half of what aggressive pruning loses; and that against quantizing the full model to the same memory, pruning wins only where quantization would have to drop below 3 bits per weight. Five attempts to overturn that crossover, with failure criteria fixed in advance (better calibration, guarded selection, causal expert importance, failure attribution, and an agentic evaluation letting each model repair its failures from execution feedback), all leave it standing; the last shows single-shot benchmarks overstate compression penalties broadly, as one repair turn erases the 2-bit quantization penalty entirely. Expert pruning works, but it demands per-model validation on the task the model will actually serve.

  • 1 authors
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Jul 17

MS-GPT: Rethinking MS/MS De Novo Structure Elucidation as Spectrum-Induced Posterior Querying of a Molecule-Language Model

Molecular structure elucidation from tandem mass spectra (MS/MS) is a central inverse problem in analytical chemistry. Most existing approaches to MS/MS identification remain tied to reference libraries or predefined candidate sets, whereas de novo methods aim to generate structures directly from spectra. A common de novo route predicts a molecular fingerprint from the spectrum and then decodes structures from it, enabling decoder pretraining on large molecule-only corpora. However, this paradigm creates a training-inference mismatch: the decoder is trained on oracle fingerprints computed from molecules, but at inference it is queried with a noisy spectrum-induced fingerprint posterior that is typically collapsed to a single thresholded fingerprint. We introduce MS-GPT, which recasts fingerprint-mediated de novo elucidation as spectrum-induced posterior querying of a conditional molecule-language model. MS-GPT conditions a molecule-language model on fingerprints and formulas, then converts the spectrum-induced posterior into a band of fingerprint queries near the oracle-fingerprint manifold through active-bit density calibration. Candidates sampled across this band are pooled and ranked by generation-frequency consensus. A lightweight LoRA adapter further mitigates domain-specific posterior bias while preserving the pretrained molecular prior. On NPLIB1 and MassSpecGym, MS-GPT sets a new state of the art, reaching Top-1/Top-10 exact-match accuracy of 29.8\%/41.1\% and 23.9\%/28.7\%, respectively. Candidate-pool scaling shows that efficient autoregressive molecular generation continues to improve recall with a little additional inference cost. The source code and model checkpoints are available at https://github.com/VIKI623/MS-GPT.

  • 8 authors
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Jul 25