We introduce Neural Subspace Reallocation (NSR), which reframes continual learning as memory management over parameter subspaces. Instead of treating Low-Rank Adaptation (LoRA) modules as disposable per-task adapters, NSR manages them as compressible, retrievable memory units on a frozen backbone through a recurring cycle: (1) compress learned LoRAs via SVD, (2) reserve them in a TaskKnowledgeBank, (3) recall related past LoRAs by embedding similarity to warm-start new or returning tasks, and (4) reallocate the active subspace accordingly, with distillation protecting prior tasks. We prove that in cyclic environments any memoryless allocation policy incurs cumulative regret Omega(T(M-1)Delta_switch) relative to a history-aware policy backed by the Bank (Theorem 1). Empirically, on Split-CIFAR-100 the Bank reduces cyclic recovery time by 10x, exactly as predicted, and on the heterogeneous 5-Datasets benchmark NSR achieves the highest accuracy and the least forgetting, about 9x closer to zero backward transfer than the memoryless heuristics. Crucially, we run a controlled study that isolates which component matters: holding the Bank fixed and varying only the allocation rule, we find that a simple similarity-based retrieval rule matches or beats a learned reinforcement-learning controller (recovering recurring tasks in 0 vs 1.8 steps and reaching equal accuracy). Our central, honest finding is therefore that the memory mechanism -- compression and similarity retrieval -- rather than a learned allocation policy, drives continual-learning performance under fixed capacity. A memory-budget analysis confirms the compressed Bank stays small -- 0.29 MB of parameter memory per task -- so a top-K retention cap bounds the total footprint while preserving fast recovery for retained tasks. less

Generative molecular design is shaped by simple proxy benchmarks for drug-like properties and models pretrained on large pharmaceutical datasets. This combination yields strong benchmark metrics but limits transferability to domains structurally distinct from drug discovery. To overcome this limitation and drive discovery toward real, scientifically grounded targets, we introduce the Nanotechnology Molecular Optimization (NMO) Benchmark, which bridges machine learning (ML) and quantum materials science. NMO acts simultaneously as a rigorous testbed for the ML community and a discovery engine for nanotechnology research. The suite replaces proxy oracles with quantum simulations and introduces strict protocols that prioritize scientific utility over leaderboard-oriented overfitting. The physics-based NMO tasks impose hard structural constraints and rugged fitness landscapes, posing fundamentally new requirements on generative models. Notably, advanced molecular optimization methods underperform much simpler approaches on the NMO tasks. We develop a new baseline method identifying the critical components to solve the NMO tasks, including a novel representation for modeling structural constraints and a domain-agnostic pretraining strategy to eliminate pharmaceutical dataset bias. Our results surpass state-of-the-art physical properties and reveal previously unknown structural motifs, offering new insights for the nanotechnology community and demonstrating that ML can drive genuine scientific discovery. less

Motion-language agents must possess the bidirectional capability to both understand human movement (motion-to-text, M2T) and generate it from natural language (text-to-motion, T2M). While foundational models have achieved strong performance in static settings, autonomous agents operating in dynamic environments must continuously incorporate new motion concepts -- such as novel athletic styles or specialized gestures -- without catastrophic forgetting of previously acquired skills. We investigate the stability-plasticity trade-off in bidirectional motion-language learning under sequential task exposure. Building on a frozen large language model backbone, we introduce low-rank adaptation (LoRA) variants designed to mitigate inter-task interference. We specifically propose mixture-of-experts architectures that utilize an autoencoder-based router to select task-specific experts at inference time, so that no task-label is needed. To evaluate these methods, we establish a reproducible five-task benchmark derived from HumanML3D through semantic clustering of motion descriptions. Our experimental results demonstrate near-zero forgetting across both M2T and T2M directions while maintaining high generation and captioning quality. Furthermore, we show that hard expert selection via routing significantly outperforms soft expert blending in quality metrics, indicating that preserving expert isolation is critical for maintaining performance in our continual learning setting. Finally, we observe that a divergence between token-level accuracy and downstream generation quality may occur, highlighting the need for more comprehensive evaluation protocols in future research on lifelong motion-language agents. less

AI models are rapidly improving at autonomous coding, as shown by benchmark progress and one-off demonstrations such as AI implementing a C compiler. However, existing coding benchmarks tend to focus on shorter tasks, and one-off demonstrations are hard to compare systematically because they often have some human guidance, and are not standardized or repeated across models. To address these challenges, we introduce MirrorCode, a long-horizon coding benchmark based on reimplementing entire software projects. In MirrorCode, AI agents must replicate the functionalities of an existing program, without access to its source code. AI solutions must match the original program's output exactly on end-to-end tests, including held-out tests. MirrorCode's 25 target programs span different areas of computing: Unix utilities, data serialization and query tools, bioinformatics, interpreters, static analysis, cryptography, and compression. Existing AI models can already reimplement complex software, with the strongest model scoring 56% across the benchmark. For example, AI can reimplement gotree, a 16,000-line bioinformatics toolkit - a task that we believe would take weeks for a human engineer. However, studying the frontier of performance requires a larger inference budget than typical benchmarks, for example, \$2,600 over 19 days for a single attempt on a large task. We show that AI agents can already complete long-horizon software engineering tasks, especially when requirements are precisely specified. More broadly, our work suggests AI will have transformative effects on software engineering, as autonomous agents continue to improve. less

Existing autonomous research agents can support parts of the research process, but most systems still treat research as either an isolated assistant task or a closed workflow. Therefore, autonomous science needs a collaboration infrastructure that coordinates projects, agents, and digital and physical resources. We identify this as a shift from code-centered execution loops to research-oriented collaboration processes, where questions, evidence, participants, and resources must be coordinated under uncertainty. In this framing, an agent may be an AI system, a human researcher, a team, a laboratory, or an organization-backed participant. To this end, we present Clarus, a collaboration infrastructure for coordinating autonomous research agents toward web-scale scientific collaboration. Clarus reformulates research as an open, auditable, attributable, and resource-aware multi-phase collaboration process. It defines a minimal project-agent-resource object model and organizes scientific collaboration through four layers including Research Application, Digital Collaboration, Physical Substrate, and Physical World. Core modules are implemented as pluggable mechanisms, allowing Clarus to adapt to task risk, collaboration structure, and resource constraints. Through a controlled paper-generation case study, we show that Clarus can organize a research goal into a traceable, reviewable, attributable, and accumulative collaboration network across phases, tasks, and participants. Together, the object model, collaboration protocol, trust mechanisms, and prototype validation provide an initial foundation for open research networks. Clarus is now available at clarus.holosai.io. less

Text-Attributed Graphs (TAGs) combine textual semantics with graph structure and are central to many graph learning tasks. However, existing fusion methods often treat text and structure as separate inputs in a shallow, one-way pipeline, which limits deep interaction between modalities and weakens performance under sparse connectivity or cross-graph generalisation. To address this issue, we propose PromptGNN-sim, a bi-directional structure-semantic fusion framework for collaborative GNN-LLM learning. PromptGNN-sim uses a Graph Attention Network (GAT) for semantically aware neighborhood selection by combining structural attention with textual similarity. The selected structural context is then used to generate structure-aware prompts for an LLM, including the target node summary, label categories, and representative keywords from similar neighbors. During training, bi-directional cross-modal contrastive learning and cross-attention are introduced to jointly optimize the GNN and LLM components. Experiments on six public datasets, including Cora, Pubmed, and WikiCS, evaluate accuracy, generalisation, and robustness under cross-task transfer, cross-dataset generalisation, and sparse perturbations. Results show that PromptGNN-sim outperforms classical GNNs, LLMs, and recent GNN-LLM fusion methods, demonstrating the effectiveness of interactive structure-semantic collaboration for text-attributed graph learning. less

Data-generating priors are a central component of tabular foundation models because they define the task distribution used during pretraining. However, priors are rarely evaluated as independent components, making it difficult to understand how much they affect downstream model behavior. This raises a methodological question: how can priors from different tabular foundation models be compared independently of the architectures and training protocols they were introduced with? To study this question, we implement a unified interface for publicly available priors from recent tabular foundation models and priors constructed from real datasets. We generate training tasks from each prior, train the same model architecture under a fixed training protocol, and evaluate the resulting models on shared downstream classification tasks. We compare priors through both generated-task statistics and downstream predictive performance. Our results show that different priors favor different downstream behaviors, with some achieving stronger absolute performance and others exhibiting more consistent relative rankings across datasets. We further find that data-level similarity only partially explains downstream behavior. Our code is available at https://github.com/automl/TFM-Playground/tree/prior-dev. less

Latent reasoning models perform multi-step inference directly in hidden-state space, yet the structure of these latent reasoning trajectories remains poorly understood. We show that contrastive refinement signals between stronger and weaker reasoning trajectories exhibit a highly concentrated low-rank structure, while unconstrained latent updates remain sensitive to paraphrases, checkpoint choice, and trajectory perturbations. These observations suggest that latent reasoning trajectories contain stable invariant directions mixed with unstable instance-specific variation. We introduce \textbf{Trajectory-Invariant Latent Refinement (TILR)}, a training-free intervention framework for identifying and manipulating stable reasoning directions in latent space. TILR first learns a low-rank invariant subspace from contrastive trajectory differences across inputs, then constrains latent interventions to this subspace while suppressing poorly aligned updates through an adaptive alignment gate. Across six reasoning benchmarks, we find that a small number of latent directions explain most variation between strong and weak reasoning trajectories. Interventions on these directions causally improve reasoning consistency and reduce trajectory instability under paraphrases and perturbations. TILR improves answer consistency under paraphrase by ~10% and reduces latent trajectory variance by up to $50\%$ while preserving reasoning accuracy. These results support a geometric view of latent reasoning in which transferable reasoning behavior emerges from stable low-dimensional structure within hidden-state trajectories. less

Technology computer-aided design (TCAD) semiconductor device simulation is fundamentally constrained by the high computational cost of iteratively solving coupled drift-diffusion equations. Existing ML surrogates either reduce internal physics to macroscopic scalar regressions, or rely on single-step mappings that lack the iterative refinement required to resolve stiff, coupled fields. To address this, we introduce PCGD, a Physics-Guided Conditional Graph Diffusion framework operating natively on unstructured TCAD meshes to predict coupled electrostatic and carrier density fields. PCGD employs a Condition-Aware MeshGraphNet denoiser that explicitly injects boundary conditions and device structure context via global cross-attention. By augmenting data-driven denoising with a physics-guided hybrid objective that integrates exponent-free quasi-Fermi gradient matching with noise-aware PDE residuals, PCGD progressively enforce physical constraints in the iterative diffusion trajectory. This strategy successfully bypasses the numerical instabilities typical of stiff drift-diffusion equations. Evaluated on a challenging mixed PN/MOS benchmark, PCGD significantly outperforms deterministic one-step regression (1.207% error) and local diffusion (1.585% error) baselines by achieving a sub-percent mean relative field error of 0.835%, while concurrently reducing maximum PDE residual errors by nearly three orders of magnitude compared to pure diffusion. It also transfers robustly to unseen SOI topologies (0.815% error) via LoRA adaptation, using 5.30$\times$ less data and 14.34$\times$ fewer parameters than full fine-tuning. Ultimately, PCGD bridges the computational efficiency of generative surrogates with the rigorous physical fidelity of traditional TCAD, unlocking highly scalable, field-level analysis for robust device engineering. less

Diffusion Language Models (DLMs) are typically trained under fixed context structures, restricting denoising to predetermined token subsets. This creates a mismatch between training and inference, where models must operate over arbitrary configurations, leading to degradation off the training grid. We propose Adaptive Block Diffusion (ABD), which resolves this mismatch by optimizing denoising risk over a distribution of prefix-window configurations. By treating the configuration as a stochastic variable, ABD trains a single model over the full configuration space without architectural changes. We show that generalization across decoding strategies is governed by the support of the training distribution, and that ABD guarantees denoising optimality for any inference policy whose configurations are covered during training. Empirically, ABD exhibits structural invariance across decoding scales, avoiding off-grid collapse and recovering a monotonic relationship between block size and perplexity, while matching or outperforming fixed-block specialists at their target scales. less