Large Language Model-Guided NAS

Spiking neural networks (SNNs) offer low-energy sequence modeling through sparse, event-driven computation. However, interactions among spike encoding, neuronal dynamics, and information propagation complicate architecture design. Existing SNN sequence models often adapt artificial neural network (ANN) architectures designed for real-valued activations, potentially underusing spike-based communication and temporal state updates, motivating automated discovery of native SNN architectures. Most evolutionary neural architecture search (ENAS) methods operate within predefined configuration spaces, limiting discovery to mechanisms expressible within those spaces. We introduce OpenArchEvo, which uses large language models (LLMs) to evolve executable architecture code in an open program space under spiking-projection constraints. In this space, code differences need not reflect architectural novelty, while direct performance evaluation requires costly training. We construct a three-view representation spanning code, design rationale, and a behavioral fingerprint to support novelty estimation and performance prediction. The search treats predicted performance and estimated novelty as two objectives, using surrogate predictions to select candidates for expensive training evaluations. With an estimated candidate-training cost of 132 V100 GPU-days, the search uncovers multiple native SNN architectures, exemplified by three designs featuring mechanisms such as spike-activity-dependent control of state updates and residual pathways. The discovered NeuroGate surpasses the ANN DeltaNet on WikiText-103, and the discovered architectures reduce estimated architecture-level arithmetic energy by up to 50.6x (LoopMem) relative to a common dense Transformer (ANN) baseline. All code and all discovered architectures will be made publicly available soon.

EEG-based brain-computer interfaces support a broad range of applications, yet designing decoding architectures that perform well across diverse tasks remains challenging. We introduce AutoBCI, an agentic framework in which a Designer Agent and a Forecaster Agent support the discovery and selection of EEG decoding architectures across tasks. The Designer Agent performs Pool-Guided Architecture Discovery (PGAD), generating and refining architectures through training and validation across multiple EEG tasks, such as emotion recognition, motor imagery, and sleep staging. The Forecaster Agent performs Performance Estimation from Early Knowledge (PEEK), using architecture code, the training protocol, and early learning curves to predict full-budget validation performance and select promising candidates for continued training. Across 14 EEG datasets spanning motor imagery, emotion recognition, and sleep staging, we evaluate AutoBCI with six LLMs, including Opus 5.5 and GPT 5.6 Sol, and compare the architectures selected by the search procedure against ten baselines: six conventional EEG models and four foundation models. The architecture discovered by AutoBCI with Claude Opus 5.5 achieves 64.16% average test balanced accuracy (bAcc), compared with 63.87% for REVE, the strongest baseline on this metric. Using ten observed epochs, PEEK reduces mean absolute error in predicting average validation bAcc from 2.20 to 1.36 percentage points, a 38.1% reduction relative to the best-observed-score baseline.

AI-driven scientific discovery accelerates research by autonomously developing solutions and designs. Large language model (LLM) agents support this process through iterative generation and evaluation. Yet these iterations alone do not ensure cumulative progress or establish which directions to pursue next. Costly evaluation further constrains the scope of exploration. Neural architecture discovery brings these challenges together, coupling open-ended design with resource-intensive experimentation. We introduce EvoTreeNAD, a genealogy-guided evolutionary algorithm that constructs trainable architectures without a supplied seed or a hand-specified search space. Starting from an empty root, it grows a persistent genealogy in which each new node represents a complete architecture. Top-percentile values computed from each node and its descendants guide lineage selection. Using the selected design history, an Idea Agent proposes a variant and a Code Agent implements it. Each evaluated variant becomes a child node, expanding the genealogy while providing evidence for subsequent lineage selection. Our theoretical analysis establishes the existence of stationary variation regimes as the genealogy grows. Under specified variation assumptions, sustained top-percentile family values quantify the probability of generating high-reward architectures in these regimes. EvoTreeNAD discovers architectures that outperform the compared NAS and NAD baselines, achieving CIFAR-10/100 test errors of $2.05{\pm}0.06\%$ and $15.09{\pm}0.22\%$. On all six MedMNIST-v2 tasks, the discovered architectures surpass the strongest listed baselines. A controlled CIFAR-10 study further shows that EvoTreeNAD outperforms direct generation, best-of-$N$ greedy continuation, and full-family-mean routing.

Large language models (LLMs) enable neural architecture search (NAS) directly over executable neural network programs. However, code-level flexibility does not provide the architecture state needed for effective mutation: LLMs must infer tensor dependencies, editable components, and compatibility constraints from implementation details. To address this representation mismatch, we propose GraphIR, an architecture-aware intermediate representation that supplements executable programs with a mutation-aligned candidate state. GraphIR organizes each candidate through three complementary views: a computation skeleton describing tensor flow, a mutation surface exposing editable modules and operations, and a validity envelope capturing interface contracts, propagated shapes, and downstream dependencies. To evaluate our method, we construct NAS-Dependency, a 120-question benchmark covering six complementary dependency-reasoning dimensions. The diagnostic shows that GraphIR is particularly effective at identifying exact producer occurrences, tracing dependency propagation, and diagnosing interface and failure risks. Across six downstream benchmarks including CLRS, GraphIR achieves the best overall search performance while maintaining comparable model size and favorable end-to-end NAS efficiency when integrated into OpenEvolve. These results show that a mutation-oriented architecture state provides an effective interface between executable neural programs and LLM-guided architecture evolution.

Deploying convolutional neural networks generated by large language models (LLMs) on real mobile hardware requires more than GPU validation accuracy: INT8 TensorFlow Lite export, delegate selection, and on-device latency jointly determine whether a model is usable. We present an automated mobile deployment pipeline that closes the loop from QLoRA fine-tuning of an architecture-generating LLM through GPU evaluation, INT8 export, and physical-device benchmarking to gated augmentation of the training corpus. The pipeline is fully scripted and runs cycle-by-cycle without manual intervention, with resume support after interruptions. We evaluate the same frozen protocol on two benchmarks, CIFAR-10 and CIFAR-100, on a Samsung SM-P613 tablet (seed 42, 20 models per cycle, cycles 0-6). On CIFAR-10, cycle 1 is gate-accepted and improves the mobile deployment score approximately 25.6x over the baseline with a mean quantized accuracy of 46.9%; later cycles raise GPU accuracy but fail the non-decreasing mobile gate. On CIFAR-100, the pre-QLoRA baseline retains the best mobile score; iterative rounds improve GPU accuracy (up to 26.2%) yet cannot surpass cycle 0 on-device, and the training pool stalls at 19 examples after the first accepted round. Together, the two studies show that closed-loop GPU fine-tuning does not guarantee monotonic mobile gains, especially on harder classification tasks, and that multi-dataset, on-device measurement is needed to stress-test deployment objectives. We release per-cycle metrics with 95% confidence intervals, all figures, and complete reproduction commands.

Introduce a MinHash-based similarity scheduling framework that constructs a progressive curriculum over neural architecture code for LLM-based neural architecture search (NAS). Using 128-permutation MinHash signatures over normalised 7-gram source code shingles, we partition the reference pool into similarity bands and present them in increasing architectural heterogeneity, with the best LoRA adapter from each stage merged cumulatively into the backbone. We evaluate the framework on OlympicCoder-7B within the LEMUR benchmark on CIFAR-10 image classification, generating N =15 candidate architectures per epoch across six progressive fine-tuning steps. The curriculum achieves 60% peak success rate at the high-similarity level without post-processing repair. A 2*2 ablation at the most diverse level curriculum versus base model, with versus without partial interface repair reveals that without repair the base model (47% peak SR) substantially outperforms the curriculum model (7% SR), while adding partial repair brings both to 53% SR. This pattern is consistent with merge-level weight drift progressively erasing evaluator-interface priors, and suggests that interface repair and curriculum scheduling target distinct failure modes. We further report a cross-dataset transfer observation on SVHN, where direct base-model generation without curriculum warmup yields 27% peak SR at substantially lower accuracy (60.5%) than the CIFAR-10 equivalent, consistent with the increased synthesis difficulty of the unq-family anchor architecture.

Neural architecture search (NAS) methods have grown increasingly efficient, yet they remain bounded by manually engineered search spaces that require substantial domain expertise and must be rebuilt for every new task. Large language models (LLMs) can generate architectures in an open-ended space, but how to optimally divide the labor between LLM-driven design and NAS-driven search remains unexplored. We propose a mechanism that bridges these two paradigms: an LLM produces a high-quality seed architecture, then decomposes it into a "slotted architecture", a scaffold with named, interchangeable module slots that automatically defines a bounded, task-specific search space for conventional NAS to explore, without manual engineering. We instantiate this mechanism in AgentNAS, a modular three-phase pipeline in which each component's contribution can be measured independently. On 17 tasks spanning classification, dense regression, segmentation, and multi-label tagging across diverse modalities (NAS-Bench-360 and Unseen NAS), AgentNAS establishes a new state of the art on 11 tasks, outperforming published baselines including task-specific expert designs. Ablation studies show that the two search mechanisms are broadly complementary: the LLM-generated seed already surpasses published baselines on the majority of tasks, and NAS delivers additional gains in most cases through combinatorial recombination across slots, a mode of search that independent LLM samples cannot replicate. These patterns hold across three LLMs of different capability levels, confirming that the division of labor is robust. Our code is available at https://github.com/alroimfebruary/AgentNAS.

Vision-based tactile sensing converts contact-induced surface deformation into images, enabling robots to infer contact forces and fine surface textures that are not accessible through conventional vision alone. However, tactile images are sensor- and physics-specific, so effective architectures often require expert intuition and extensive manual iteration. Existing neural architecture search (NAS) pipelines can reduce this burden, but they are often computationally expensive and restricted to hand-designed search spaces, which limits architectural novelty and diversity. We introduce TacEvo, a self-evolving architecture discovery framework that improves network designs from downstream feedback. TacEvo uses an LLM to generate code-level mutations and crossovers, and a MAP-Elites quality-diversity loop that preserves diverse elite architectures while preferentially reusing prompts that consistently yield improvements. Exploration is guided by two behavioural descriptors, Architectural Diversity and Efficiency Ratio, which encourage coverage across structural variations and compute-size trade-offs. On ViTacTip force regression and grating classification, TacEvo achieves high autonomous generation reliability (96.0%/94.5% trainable) and improves best validation fitness over 20 generations by 56.1%/96.1%. In a 20-seed post-search high-fidelity evaluation, TacEvo matches the expert baseline on force prediction and outperforms it on fine-grained grating classification. These results suggest that LLM-driven self-evolving search constitutes a practical paradigm for AI-assisted scientific discovery in specialised robotic sensing.

In actor-critic reinforcement learning, network architectures are typically manually designed. Automating this design is challenging because each candidate must be trained before evaluation, and the design space is open-ended. To address these challenges, we introduce EVOM, an agentic meta-evolution framework for discovering high-performance actor-critic architectures. We frame architecture search as a bi-level optimization: an inner loop trains weights via the low-fidelity proximal policy optimization (PPO), while an outer loop drives meta-evolution by iteratively refining architecture programs. Crucially, this outer loop is powered by an LLM-based design agent that operates purely as an architecture designer, completely decoupled from policy execution and environment control. Experiments reveal that EVOM outperforms the manually designed baseline, an LLM-guided random search, and the state-of-the-art LLM-guided programmatic policy search method MLES, delivering superior performance on Ant-v4 and HalfCheetah-v4. Ablation studies validate that both the meta-evolution loop and the LLM Design Agent are indispensable for final performance.

Designing neural architectures for time-series forecasting and anomaly detection remains a resource-intensive task that often requires substantial domain expertise. Traditional Automated Machine Learning (AutoML) systems typically rely on static, predefined search spaces, limiting their ability to adapt to diverse data characteristics. We present GenAutoML, an agentic framework that leverages Large Language Models (LLMs) as neural architects to bridge natural-language requirements and executable PyTorch implementations. The framework incorporates a Sandboxed Reflection Loop for autonomous code refinement and a Signature-Aware Runtime that enforces architectural consistency and execution safety. To improve robustness under non-stationary conditions, we further introduce a Dynamic Reversible Instance Normalization (Dyn-RevIN) wrapper. Experiments on the ETTh1, ETTm1, and Weather benchmarks demonstrate that GenAutoML can dynamically generate task-specific neural architectures tailored to dataset characteristics. Among the generated models, WaveInterferenceNet achieves inference latency below 0.01 ms per sample while maintaining competitive predictive performance. By emphasizing computational efficiency, architectural adaptability, and stable optimization behavior, GenAutoML enables the creation of ultra-lightweight neural networks suitable for resource-constrained and latency-sensitive Edge AI deployments.

Current neural architecture search (NAS) methods are often limited by their predefined, restrictive search spaces. While recent large language model (LLM)-assisted NAS methods enable open-ended search spaces, they often suffer from inefficient exploration due to biased or low-quality design ideas. To address these issues, we propose to semi-automatically structure model design knowledge to guide the search process. Our approach first defines a high-level structural template of architectural attributes. An LLM then populates this template by analyzing papers, creating a rich and diverse search space that embodies this structured design knowledge. To efficiently explore this vast space, we introduce FairNAD, using a multi-type mutation that enables broad exploration through mutation with fair idea sampling, Pareto-aware mutation, LLM-driven iterative mutation, and a fine-grained feedback loop. We demonstrate the effectiveness of FairNAD in discovering high-performing architectures that yield 0.84, 2.17, and 2.35 points improvement on CIFAR-10, CIFAR-100, and ImageNet16-120, respectively, compared to current state-of-the-art methods.

Toward recursive self-improvement, we investigate LLM agents autonomously designing foundation models beyond standard Transformers. We introduce a dual-framework approach: AIRA-Compose for high-level architecture search, and AIRA-Design for low-level mechanistic implementation. AIRA-Compose uses 11 agents to explore fundamental computational primitives under a 24-hour budget. Agents evaluate million-parameter candidates, extrapolating top designs to 350M, 1B, and 3B scales. This yields 14 architectures across two families: AIRAformers (Transformer-based) and AIRAhybrids (Transformer-Mamba). Pre-trained at 1B scale, these consistently outperform Llama 3.2 and Composer-found baselines. On downstream tasks, AIRAformer-D and AIRAhybrid-D improve accuracy by 2.4% and 3.8% over Llama 3.2. Furthermore, AIRA-Compose finds models with highly efficient scaling frontiers: AIRAformer-C scales 54% and 71% faster than Llama 3.2 and Composer's best Transformer, while AIRAhybrid-C outscales Nemotron-2 by 23% and Composer's best hybrid by 37%. AIRA-Design tasks 20 agents with writing novel attention mechanisms for long-range dependencies and high-performing training scripts. On the Long Range Arena benchmark, agent-designed architectures reach within 2.3% and 2.6% of human state-of-the-art on document matching and text classification. On the Autoresearch benchmark, Greedy Opus 4.5 achieves 0.968 validation bits-per-byte under a fixed time budget, surpassing the published minimum. Together, these frameworks show AI agents can autonomously discover architectures and algorithmic optimizations matching or surpassing hand-designed baselines. This establishes a powerful paradigm for discovering next-generation foundation models, marking a clear step toward recursive self-improvement.

Large language models (LLMs) show strong potential for neural architecture generation, yet existing approaches produce complete model implementations from scratch -- computationally expensive and yielding verbose code. We propose Delta-Code Generation, where fine-tuned LLMs generate compact unified diffs (deltas) to refine baseline architectures rather than synthesizing entire models. Our pipeline iteratively fine-tunes the LLM via LoRA on curated architectures from the LEMUR dataset, with MinHash-Jaccard novelty filtering for structural diversity. We evaluate three 7B-class LLMs -- DeepSeek-Coder-7B, Qwen2.5-Coder-7B, and Mistral-7B -- across six datasets (CIFAR-10, CIFAR-100, MNIST, SVHN, ImageNette, CelebA) using a 22-cycle protocol (1,100 candidates per LLM). All three substantially surpass the full-generation baseline (50.6% valid rate, 42.3% mean first-epoch accuracy): DeepSeek-Coder reaches 75.3% valid rate and 65.8% mean accuracy; Qwen2.5-Coder 72.1%/64.6%; Mistral 66.6%/66.1%. On CIFAR-10, best first-epoch accuracies reach 85.5% (Mistral), 85.2% (DeepSeek), 80.6% (Qwen) -- well above 63.98% full generation and 71.5% for the concurrent approach of Gu et al. Output lengths are 30-50 lines versus 200+ for full generation (75-85% reduction). A 50-epoch study confirms the 1-epoch proxy preserves rankings (Mistral: Spearman $ρ$ = 0.926). Delta-based generation is a token-efficient, multi-domain, LLM-agnostic alternative to full-model synthesis for LLM-driven NAS.

Neural Architecture Search (NAS) aims to automatically discover high-performing deep neural network (DNN) architectures. However, conventional algorithm-driven NAS relies on carefully hand-crafted search spaces to ensure executability, which restricts open-ended exploration. Recent coding-based agentic approaches using large language models (LLMs) reduce manual design, but current LLMs struggle to reliably generate complex, valid architectures, and their proposals are often biased toward a narrow set of patterns observed in their training data. To bridge reliable algorithmic search with powerful LLM assistance, we propose LLMasTool, a hierarchical tree-based NAS framework for stable and open-ended model evolution. Our method automatically extracts reusable modules from arbitrary source code and represents full architectures as hierarchical trees, enabling evolution through reliable tree transformations rather than code generation. At each evolution step, coarse-level planning is governed by a diversity-guided algorithm that leverages Bayesian modeling to improve exploration efficiency, while the LLM resolves the remaining degrees of freedom to ensure a meaningful evolutionary trajectory and an executable generated architecture. With this formulation, instead of fully agentic LLM approaches, our method explores diverse directions beyond the inherent biases in the LLM. Our method improves over existing NAS methods by 0.69, 1.83, and 2.68 points on CIFAR-10, CIFAR-100, and ImageNet16-120, demonstrating its effectiveness.

This paper focuses on a key challenge in Neural Architecture Search (NAS): integrating established architectural knowledge while exploring new designs under expensive evaluations. Large language models (LLMs) are a promising assistant for NAS because they can translate rich architectural and coding priors into executable code edits. However, in practice, seemingly local revisions often propagate into non-local behavioral and performance shifts because a single edit can inadvertently couple multiple interacting functional factors, a phenomenon we refer to as functional entanglement. To make LLM knowledge usable under such entanglement, we propose Structured Progressive Knowledge Activation (SPARK), which activates relevant priors by explicitly selecting the functional factor to modify and conditioning the edit on that factor. This factor-conditioned editing reduces entangled side effects and yields more targeted, reliable architecture modifications. On CLRS-DFS, SPARK achieves a 28.1x sample-efficient architecture evolution speedup and yields a 22.9% relative improvement in OOD accuracy. Our code is available at https://github.com/AIM-ResearchLab/SPARK.