NeurIPS 2026 论文列表

Conference on Neural Information Processing Systems

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6,437篇论文

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gfnx: Fast and Scalable Library for Generative Flow Networks in JAX

Daniil Tiapkin, Artem Agarkov, Nikita Morozov, Ian Maksimov, Askar Tsyganov, Timofei Gritsaev, Sergey Samsonov

展开摘要

In this paper, we present gfnx, a fast and scalable package for training and evaluating Generative Flow Networks (GFlowNets) written in JAX. gfnx provides an extensive set of environments and metrics for benchmarking, accompanied with single-file implementations of core objectives for training GFlowNets. We include synthetic hypergrids, multiple sequence generation environments with various editing regimes and particular reward designs for molecular generation, phylogenetic tree construction, Bayesian structure learning, and sampling from the Ising model energy. Across different tasks, gfnx achieves significant wall-clock speedups compared to Pytorch-based benchmarks (such as torchgfn library) and author implementations. For example, gfnx achieves up to 55 times speedup on CPU-based sequence generation environments, and up to 80 times speedup with the GPU-based Bayesian network structure learning setup. Our package provides a diverse set of benchmarks and aims to standardize empirical evaluation and accelerate research and applications of GFlowNets.

Poster
dRAE: Representation Autoencoder with Hyper-Spherical Codes

Tianren Ma, Lin Long, Chuyan Chen, Mu Zhang, Junbo Zhao, Tong Zhang, Qixiang Ye

展开摘要

Multi-modal models require visual tokenizers that jointly capture high semantic density and fine-grained structural fidelity. Representation Autoencoders (RAEs) offer a promising direction by decoding images directly from a pre-trained semantic space using high-dimensional continuous tokens, bypassing the information bottleneck of VAEs and benefiting both visual understanding and generation. In this work, we aim to discretize these continuous vision representations to bridge the gap with language models — a non-trivial challenge, as existing quantization methods suffer from codebook collapse, failing to scale while preserving semantic coherence. We identify the root cause as **metric mismatch**: standard Euclidean codebook objectives are fundamentally misaligned with the anisotropic geometry of representation space, leading to codebook embeddings with high-variance magnitude scales and uneven angular distributions that hinder scalability. To address this, we propose **Hyper-Spherical Quantization (HSQ)** , which decouples semantic content from feature magnitude via angular routing, preventing code assignment from being dominated by scale rather than meaning. The resulting **discrete Representation Autoencoder (dRAE)** achieves high-fidelity reconstruction while preserving semantic integrity and supporting scalable discrete latent spaces. Extensive experiments demonstrate consistent performance gains as the vocabulary size scales to $131,072$, along with strong unified performance across both visual understanding and generation benchmarks.

Poster
WorldComposer: Generative High-Fidelity Simulation with Digital Cousins for Generalizable Robot Learning and Evaluation

Jasper Lu, Zhenhao Shen, Yuanfei Wang, Shugao Liu, Shengqiang Xu, Shawn Xie, Jingkai Xu, Feng Jiang, Jade Yang, Chen Xie, Ruihai Wu

展开摘要

Learning robust robot policies in real-world environments requires diverse data augmentation, yet scaling real-world data collection is costly due to the need for acquiring physical assets and reconfiguring environments. Therefore, augmenting real-world scenes into simulation has become a practical augmentation for efficient learning and evaluation. We present WorldComposer, an automated generative Real2Sim2Real framework that maps real-world panoramas into high-fidelity, task-ready simulation environments and further synthesizes diverse Digital Cousins through scene and object variations. Combined with high-quality physics engines and realistic assets, WorldComposer supports interactive manipulation across rigid, articulated, and deformable objects. Additionally, we incorporate multi-room stitching to construct consistent large-scale environments for long-horizon tasks. Experiments demonstrate a strong sim-to-real correlation validating our platform's fidelity, and show that extensively scaling up data generation leads to significantly better generalization to unseen scene and object variations, demonstrating the effectiveness of Digital Cousins for generalizable robot learning and evaluation.

Poster
Why Pass@k Optimization Can Degrade Pass@1: Prompt Interference in LLM Post-Training

Anas Barakat, Souradip Chakraborty, Khushbu Pahwa, Amrit Singh Bedi

展开摘要

Pass@$k$ is a widely used performance metric for verifiable large language model tasks, including mathematical reasoning, code generation, and short-answer reasoning. It defines success if any of $k$ independently sampled solutions passes a verifier. This multi-sample inference metric has motivated inference-aware fine-tuning methods that directly optimize pass@$k$. However, prior work reports a recurring trade-off: pass@$k$ improves while pass@1 degrades under such methods. This trade-off is practically important because pass@1 often remains a hard operational constraint due to latency and cost budgets, imperfect verifier coverage, and the need for a reliable single-shot fallback. We study the origin of this trade-off and provide a theoretical characterization of when pass@$k$ policy optimization can reduce pass@1 through gradient conflict induced by prompt interference. We show that pass@$k$ policy gradients can conflict with pass@1 gradients because pass@$k$ optimization implicitly reweights prompts toward low-success prompts; when these prompts are what we term \emph{negatively interfering}, their upweighting can rotate the pass@k update direction away from the pass@1 direction. We illustrate our theoretical findings with large language model experiments on verifiable mathematical reasoning and coding tasks.

Poster
Why Cross-Skeleton Retargeting Is Non-Identifiable: Structural Limits of Generative Motion Models

Zhiyuan Li, Wenyan Yang, Pekka Marttinen, Joni Pajarinen

展开摘要

Cross-skeleton motion generation trains generative models to carry action structure and motion intention from one body to another. Yet an action-consistent target motion admits two observationally compatible explanations: source-preserving transfer and target-action recovery. We show that this ambiguity is structural rather than incidental: under standard generative objectives, the source-conditioned retargeting map is non-identifiable in sparse heterogeneous motion domains. Unpaired marginal matching yields \emph{gauge non-identifiability}: a relative gauge between skeleton-specific latent spaces allows different source-conditioned maps to induce the same training evidence. Sparse paired supervision admits the complementary failure mode, \emph{conditional-mean degeneration}: ambiguous action-level pairings drive squared-error objectives toward a target-action prototype that is independent of the source clip's motion intention. To make the missing evidence observable, we introduce \emph{Source-Instance Fidelity} (SIF), a diagnostic that tests whether the source-side geometry remains visible in the generated target motions after the target skeleton and action are fixed. Under this diagnostic, standard action-level success across animal motion domains recurrently coincides with behavior at the \emph{source-blind floor}, while positive cases localize source-instance information to auxiliary motion-space constraints that narrow the observational equivalence class. The implication is that retargeting requires objectives and evaluations capable of identifying the source-conditioned map that a retargeting claim asserts. [Project page](https://keen-semolina-09811d.netlify.app/).

Poster
When and Why SignSGD Outperforms SGD: A Theoretical Study Based on $\ell_1$-norm Lower Bounds

Hongyi Tao, Dingzhi Yu, Lijun Zhang

展开摘要

Sign-based optimization algorithms, such as SignSGD and Muon, have garnered significant attention for their remarkable performance in training large foundation models. Despite this empirical success, we still lack a theoretical understanding of when and why these sign-based methods outperform vanilla SGD. The core obstacle is that under standard smoothness and finite variance conditions, SGD is known to be minimax optimal for finding stationary points measured by $\ell_2$-norms, thereby fundamentally precluding any complexity gains for sign-based methods in standard settings. To overcome this barrier, we analyze sign-based optimizers leveraging $\ell_1$-norm stationarity, $\ell_\infty$-smoothness, and a separable noise model, which can better capture the coordinate-wise nature of signed updates. Under this distinct problem geometry, we derive matched upper and lower bounds for SignSGD and explicitly characterize the problem class in which SignSGD provably dominates SGD. Specifically, we compare the *upper bound of SignSGD* with the *lower bound of SGD*, illustrating that SignSGD effectively reduces the complexity by a factor of $d$ under *sparse noise*, where $d$ is the problem dimension. Furthermore, we elevate this framework to the matrix domain, providing an equivalent optimal lower bound for the Muon optimizer, proving that extending the sign operator to matrices preserves this optimal scaling with dimensionality. Finally, we bridge our theoretical bounds to practice, demonstrating that the theoretical superiority of SignSGD accurately predicts its faster convergence during the pretraining of a 124M parameter GPT-2 model.

Poster
When and Why Adversarial Training Improves PINNs: A Neural Tangent Kernel Perspective

Yuandong Cao, Chi C So, Jun-Min Wang, He Wang

展开摘要

Physics-informed neural networks (PINNs) are powerful surrogates for differential equations but are notoriously difficult to train due to spectral bias, stiffness, and poor accuracy on high-frequency or multiscale solutions. Adversarial training based on generative adversarial networks (GANs) has recently gained surprisingly strong empirical results in improving training, but the underlying mechanisms remain elusive. To this end, we propose a new analysis framework for adversarially trained PINNs, based on the key observation of how the discriminator in GANs can influence the training dynamics of PINNs. The framework first provides a much needed theoretical grounding to why and when adversarial training is effective in PINNs, then presents a unified analysis of GANs variants in such training, and finally leads to a new, practical, efficient training algorithm for PINNs. Empirical results demonstrate that our method can significantly reduce the pathology of PINNs training, thereby providing better models with superior performances, often several magnitudes more accurate than alternative methods.

Poster
When and How to Canonize: a Generalization Perspective

Yonatan Sverdlov, Benjy Friedmann, Snir Hordan, Nadav Dym

展开摘要

While equivariant architectures are standard for processing symmetric data, there is growing interest in achieving equivariance by applying group averaging or canonization to non-equivariant backbones. However, the theoretical generalization properties of these alternative strategies remain poorly understood. We introduce a theoretical framework to analyze the generalization error of these methods by bounding their covering numbers. We establish a rigorous generalization hierarchy: the error bounds of canonized models are at best equal to the error bounds of structurally equivariant and group-averaged models, and at worst equal to the bounds of non-equivariant baselines. Furthermore, we show that there exist "optimal" canonizations which attain the optimal error bounds, and "poor" canonizations which attain the non-equivariant error bounds, and that this depends on the regularity of the canonization. Finally, applying this framework to permutation groups in point cloud processing, we rigorously prove that the covering number of lexicographical sorting grows exponentially with point cloud dimension, whereas Hilbert curve canonization guarantees polynomial growth. This provides the first formal theoretical justification for the empirical success of Hilbert curve serialization in state-of-the-art point cloud architectures. We conclude with experiments which support our theoretical claims.

Poster
When Metropolis and Hastings Meet Bradley and Terry: Exact MCMC From Preference Voting

Ariel Smogorghevski, Nir Rosenfeld, Yaniv Romano

展开摘要

conditioned on desired semantic properties is an emerging challenge in modern generative modeling. Metropolis-Hastings (MH) provides a principled route to conditional sampling, but requires access to exact pointwise target-density evaluations, which are not available in generative settings. Meanwhile, pairwise comparisons by humans or model ``judges'' are highly accessible and have proved valuable across diverse applications. We introduce Pref-MH, a general exact MH sampler for judge-induced conditional distributions using only stochastic binary pairwise comparisons. Our key observation is that the MH unnormalized density ratio matches the preference odds of BT choice models. The central challenge is that while MH requires precise ratio computation, BT judges provide only sampled binary feedback. To this end, we develop a valid accept/reject rule whose resulting Markov chain provably converges to the target distribution. We further show that, for a fixed proposal kernel and budget, Pref-MH is optimal in the Peskun-Tierney sense among this class of exact reversible acceptance rules. Experiments on text generation with LLM judges and image generation with VLM judges demonstrate that Pref-MH provides a practical and flexible approach to conditional sampling from comparative feedback.

Poster
When Less is More: The LLM Scaling Paradox in Context Compression

Ruishan Guo, Yibing Liu, Guoxin Ma, Yan Wang, Yueyang Zhang, Long Xia, Kecheng Chen, Zhiyuan Sun, Daiting Shi

展开摘要

Scaling up model parameters has long been a prevalent training paradigm driven by the assumption that larger models yield superior generation capabilities. However, under lossy context compression in a compressor--decoder setup, we find a \textbf{\textit{Size-Fidelity Paradox}}: increasing compressor size can lessen the faithfulness of reconstructed contexts though reconstruction error decreases. Across 27 compressor setups spanning model families, scales, and compression rates, we coin this paradox arising from two dominant factors: 1) \textit{knowledge overwriting}: larger models increasingly replace source facts with their own prior beliefs, \textit{e.g.}, ``the white strawberry`` $\to$ ``the red strawberry``; and 2) \textit{semantic drift}: larger models tend to paraphrase or restructure content instead of reproducing it verbatim, \textit{e.g.}, ``Alice hit Bob`` $\to$ ``Bob hit Alice``. Interestingly, this paradox persists across varied settings, with mid-sized compressors often outperforming larger ones in faithful recovery. By analyzing the compressed memory via embedding geometry and reconstruction determinacy, we further reveal that compressors tend to organize memory across broader semantic subspaces, yielding more ambiguous representations prone to overwriting, drift, and weakened recovery. These findings complement existing evaluations of context compression and expose a breakdown of scaling laws when the objective shifts from plausible generation to faithful preservation.

Poster
When Edge Independence Fails: Joint Graph Diffusion with Latent Sociability Priors

Adarsh Jamadandi, Nicolas Keriven, Aline Roumy

展开摘要

Discrete graph diffusion models corrupt graph structure through independent edge updates with a Markovian noise model. Combined with the exchangeability requirement on the output distribution, the terminal prior is necessarily an Erd\H{o}s--R\'enyi (E-R) random graph. This has a fundamental consequence for unconditional graph generation without node features: in the large graph limit, any GNN denoiser applied to an E-R graph approximately outputs an E-R graph, making effective denoising difficult. In practice, generated graphs fail to recover meaningful node heterogeneity and higher-order structure. Previous models introduced specialized node features to compensate, framing this as an expressivity problem, while the role of the prior remained unexamined. We instead address the root cause by introducing the \emph{Latent Sociability Prior} (LSP) and a \emph{joint} diffusion process that co-evolves latent node sociability variables and graph structure, removing edge independence while preserving exchangeability. Unlike existing latent graph diffusion methods, the sociability mechanism requires no complex encoder: its sole role is to guide edge updates and preserve node heterogeneity throughout the trajectory. We validate our approach on multiple graph generation datasets and show that the proposed framework more accurately captures graph distributions than baseline methods without node features.

Poster
When Are Compositional Problems Learnable from Verifiable Rewards?

Daniel Barzilai, Yotam Wolf, Ronen Basri

展开摘要

Many problems are inherently compositional: solving them requires a sequence of intermediate decisions that jointly determine the final answer. A central question is when such a compositional structure can be learned from outcome-level feedback alone, where supervision of the intermediate steps is unavailable. We study this question for autoregressive models trained using reinforcement learning with verifiable rewards (RLVR). We identify the \emph{task-advantage ratio}, a joint property of the task and the model, which measures whether intermediate decisions present an advantage in reaching a correct final solution. We show that this ratio governs learnability in our setting: when the advantage is present, RLVR efficiently learns the target composition, while when it is absent, training can converge to suboptimal compositions. We further show that the required advantage arises naturally in several structured problems, but may depend critically on the quality of the initial model. Our results help to clarify when compositional problems can be learned from final rewards alone.

Poster
What Matters for Diffusion-Friendly Latent Manifold? Prior-Aligned Autoencoders for Latent Diffusion

Zhengrong Yue, taihang Hu, Mengting Chen, Haiyu Zhang, Zihao Pan, Tao Liu, Zikang Wang, Jinsong Lan, Xiaoyong Zhu, Bo Zheng, Yali Wang

展开摘要

Tokenizers are a crucial component of latent diffusion models, as they define the latent space in which diffusion models operate. However, existing tokenizers are primarily designed to improve reconstruction fidelity or inherit pretrained representations, leaving unclear what kind of latent space is truly friendly for generative modeling. In this paper, we study this question from the perspective of latent manifold organization. By constructing controlled tokenizer variants, we identify three key properties of a diffusion-friendly latent manifold: coherent spatial structure, local manifold continuity, and global manifold semantics. We find that these properties are more consistent with downstream generation quality than reconstruction fidelity. Motivated by this finding, we propose the $\textit{\textbf{P}rior-\textbf{A}ligned Auto\textbf{E}ncoder} (\textbf{PAE})$, which explicitly shapes the latent manifold instead of leaving diffusion-friendly manifold to emerge indirectly from reconstruction or inheritance. Specifically, PAE leverages refined VFM-derived priors and perturbation-based regularization to turn spatial structure, local continuity, and global semantic organization into explicit training objectives. On ImageNet $256{\times}256$, PAE improves both training efficiency and generation quality over existing tokenizers, reaching comparable performance up to $13\times$ faster than RAE under the same LightningDiT setup and achieving a new state-of-the-art gFID of $\textbf{1.03}$. These results highlight the importance of organizing the latent manifold for latent diffusion models.

Poster
What Makes a Good Path? Factoring Manifold Support and Path Geometry

Zhixuan Zhou, Tingting Dan, Guorong Wu

展开摘要

The manifold hypothesis suggests that real-world data concentrates on low-dimensional structures, yet navigating meaningful trajectories on latent manifolds remains an open challenge. A common approach is to construct density-aware metrics, but such constructions bundle two distinct questions: (i) where valid data lies and (ii) how we choose to traverse on the manifold. Since different tasks may demand different traversal behaviors even on the same data manifold, specifying these two aspects independently offers additional modeling flexibility. We propose to factor the path objective into a kinetic term governed by a freely chosen geometric prior and a score-based potential, derived from the negative log-density of a pretrained diffusion model, that acts as a soft constraint for manifold adherence. The potential encourages dynamics to evolve along the data support, while the geometric prior remains free to encode task-specific notions of path optimality. To solve the resulting optimization problem, we introduce \textit{geodesic force matching} (GFM), a direct-collocation algorithm that discretizes the trajectory and optimizes all waypoints jointly to satisfy the Euler--Lagrange force balance in a least-squares sense. On synthetic manifolds and 3D shape interpolation, our method produces smooth, on-manifold paths and performs favorably against recent density-aware baselines, most notably in the low-noise regime where those baselines become numerically unstable.

Spotlight
What Drives Compositional Generalization? The Importance of Continuous Training Objectives in Visual Generative Models

Karim Farid, Rajat Sahay, Yumna Alnaggar, Simon Schrodi, Volker Fischer, Cordelia Schmid, Thomas Brox

展开摘要

Compositional generalization, the ability to generate novel combinations of known concepts, is a key ingredient for visual generative models. Yet, not all mechanisms that enable or inhibit it are fully understood. In this work, we conduct a systematic study of which design choices critically determine compositional generalization in image and video generation. By isolating independent design axes, we identify two key factors that determine compositional success: (i) whether the training objective operates on a discrete or continuous distribution, and (ii) the completeness of conditioning information about constituent factors during training. We also show that relaxing the discrete loss with an auxiliary continuous latent objective can partially recover compositional performance in discrete models like MaskGIT. Our findings, corroborated by diverse compositional tasks and preliminary evidence in world models and LLMs, motivate a shift toward continuous objectives for compositional generalization.

Poster
What Does a Sparse Autoencoder Feature Do? A Weight-Based Account

Yiting Liu, Zhihong Deng

展开摘要

Sparse autoencoders (SAEs) have emerged as a powerful technique for decomposing language model representations into interpretable features. Current interpretation pipelines infer feature semantics from activation patterns, implicitly assuming every feature has a semantic explanation while overlooking the computational roles features inherit from the SAE training objective. We introduce a weight-based interpretation framework that requires no activation data and grounds claims causally through targeted feature-ablation interventions. Across Gemma-2 and Llama-3.1, three depth-dependent signatures show that SAE features inherit the base model's geometry: semantic features form a U-shape under tied embeddings but bifurcate when untied, attention participation peaks mid-layer, and the two roles couple oppositely for input- vs. output-oriented features. This weight-based view supplies the causal half missing from activation-based interpretability.

Poster
What Cohort INRs Encode, and Where to Freeze Them

Vasiliki Sideri-Lampretsa, Sophie Starck, Robbie Holland, Julian McGinnis, Daniel Rueckert

展开摘要

Reusing the early layers of cohort-trained INRs as initialization for new signals has been shown to accelerate and improve signal fitting, yet it remains unclear which layers of the shared encoder learn transferable representations and what those representations encode. We address both questions for two standard backbones, SIREN and Fourier-feature MLPs (FFMLP). First, sweeping the freeze depth across the shared encoder at test time, we find that the optimum coincides with the layer of highest weight stable rank. Moreover, freezing at this depth matches or improves on the standard fine-tuning recipe across all our experiments. Second, identifying which layer transfers does not characterize what that layer encodes. To address this we adopt sparse autoencoders (SAEs), the dominant tool in mechanistic interpretability, and present the first SAE decomposition of INR activations into sparse dictionary atoms. Interestingly, SIREN and FFMLP achieve comparable cohort-fitting quality, but learn qualitatively different dictionaries. Cohort SIREN's atoms are localized, tiling the coordinate plane such that each atom fires in a confined region independent of cohort content. Cohort FFMLP's atoms are image-spanning, tracing the contours of memorized cohort signals. Single-atom ablations confirm causal use of these dictionaries: a single FFMLP atom out of 4096 can drop PSNR by up to 10.6 dB across the image, while SIREN ablations remain confined to where the atom fires. Together, these results give the first mechanistic account of what transfers in cohort-trained INRs and turn their activations into inspectable dictionary atoms. These tools open a path towards characterizing what INRs encode and towards architectures designed for generalization rather than memorization. We plan to release our code upon acceptance.

Poster
What Can Labels Alone Audit and Edit in Frozen Representations?

Yirong Xiang, Yibo Zhou

展开摘要

Frozen representations are often adapted using task labels alone, without environment, nuisance, or concept annotations. In this label-only regime, the first question is identifiability: what semantic target is actually determined by the joint law of representation and label? We show that labels identify only the posterior quotient, equivalently the coarsest deterministic representation that preserves all label information, and do not identify a finer semantic/background decomposition. This yields a quotient-first principle for label-only auditing and editing: first estimate a low-dimensional label-sufficient surrogate, then analyze residual class-dependent structure only after removing it. Under a structured linear second-order specialization, this leads to dual-moment decomposition (DMD). Empirically, stage one is a strong semantic audit and label-preserving compression baseline across frozen CelebA, Waterbirds, and PACS features, while stage-two residual editing improves leakage--label tradeoffs only in some regimes. Overall, the results support a conservative recipe for label-only frozen-feature editing: preserve the quotient first, and trust residual edits when residual support and split stability are strong.

Poster
Wavelet Flow Matching for Multi-Scale Physics Emulation

Gabriele Accarino, Juan Nathaniel, Carla Roesch, Pierre Gentine, Sara Shamekh, Duncan Watson-Parris, Viviana Acquaviva

展开摘要

Accurate emulation of multi-scale physical systems governed by PDEs demands models that remain stable over long autoregressive rollouts while preserving fine-scale structures. Deterministic emulators produce overly-smoothed predictions, while generative approaches better capture details but are costly. Latent-space generative models have emerged as a compromise but with the additional cost of separately pre-trained autoencoders. We propose **Wavelet Flow Matching** (WFM), a novel generative emulator that overcomes current trade-offs between cost and skill by performing optimal-transport directly in the multi-scale wavelet space. Rather than learning a latent compression, WFM leverages the hierarchical structure of a U-Net to jointly predict transport velocities of a prescribed wavelet representation. On three challenging systems of chaotic fluid dynamics, WFM achieves superior long-horizon stability, accuracy and spectral coherence compared to state-of-the-art models. Our results clearly position the wavelet space as an effective training-free representation for generative emulation of complex physical dynamics.

Poster
Vermeer: Autoregressive generative modeling of microscopy predicts protein localization

Sandeep Kambhampati, Eric Zimmermann, Emre Hayir, Kevin K Yang, Fei Chen, Alex X Lu

展开摘要

Fluorescent microscopy provides a rich view into how proteins localize within cells, but it remains experimentally infeasible to image human proteins across all of the different factors that can impact localization. We introduce Vermeer, a channel-adaptive autoregressive generative model for in silico generation of microscopy images of protein localization. Vermeer conditions generations on protein sequences and landmark stains showing the morphology of cells, which enables it to generalize to unseen proteins and cell lines. We show that Vermeer, trained on the Human Protein Atlas, can generate images with substantially improved perceptual quality and biological fidelity over previous proposals. Additionally, Vermeer's autoregressive framework enables flexible generation using varying channel subsets and orderings, enabling zero-shot transfer to data collected under different imaging conditions and channel configurations than those used for training. These results position Vermeer to enable scalable modeling of protein localization and is a step towards generative foundation models that can operate over distinct microscopy datasets.

Poster