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Sumin Lee

Publications and source records attributed to Sumin Lee.

At least 19 recordsLinked to original sources

Spatial proteomics guided by H&E-based AI reveals recurrence-risk niches in triple-negative breast cancer

Deep learning models can predict cancer recurrence from H&E stained slides, but the localized molecular states underlying these predictions remain largely obscured. Here, we developed an outcome informed spatial pathology framework in TNBC that integrates AI generated recurrence risk heatmaps with mass spectrometry based spatial proteomics. In a cohort of 156 patients, distribution based aggregation of high scoring patches achieved an AUC of 0.77 and a C-index of 0.77 in an independent test cohort. Bulk proteomics associated high image derived risk with cell cycle and genome maintenance programs and low risk with immune activation. High and low risk patches coexisted within the same tumor compartment and displayed distinct nuclear and architectural features, revealing intratumoral heterogeneity beyond tissue compartment identity. We then used the heatmaps as coordinate level guides to physically isolate and profile 46 AI defined tumor regions from two recurrence patients. Spatial proteomic profiling revealed a concordant molecular contrast across both patients: mitotic programs were enriched in high risk regions and immune and antigen presentation programs in low risk regions. A 13 protein composite derived from these spatial contrasts showed a trend toward poorer recurrence-free survival with increasing scores in an expanded cohort, while the corresponding transcript based composite stratified recurrence free survival in the independent METABRIC TNBC cohort. Integrating the protein composite with the H&E derived risk score improved the out of bag C-index from 0.679 to 0.739 and enhanced time dependent discrimination at 3 and 5 years. Together, these findings define a new role for outcome trained AI models as spatially explicit experimental guides that connect prognostic morphology with localized molecular states and advance biologically grounded, multiscale biomarker discovery in TNBC.

cs.AI

LEXIC: Lightweight Eye-tracking eXtension via Injected Complexity

On the recent EyeBench benchmark, predicting reading comprehension from eye movements exposes a stark gap: text-aware models using pretrained language models reach 56--63% AUROC, while gaze-only models operate at chance. We ask how far a gaze-only model can be pushed by lightweight, language-model-free conditioning. Building on the EyeBench AhnCNN baseline, LEXIC-Base, we propose two mechanisms to inject three precomputed word-level difficulty signals, GPT-2 surprisal, word frequency, and word length, into the per-fixation input: direct concatenation, LEXIC-Concat, and a residual mechanism, LEXIC-Res, where a small head predicts typical-reader gaze response and the encoder is conditioned on the deviation. On the OneStop reading comprehension task, with K=5 seed-ensemble training across ten folds, both mechanisms produce statistically consistent AUROC gains on Unseen Text, +1.8 to +2.2 percentage points, Wilcoxon p <= 0.065. LEXIC-Concat additionally lifts Unseen Reader by +2.9 percentage points, p = 0.010. We trace an architectural boundary in LEXIC-Res on Unseen Reader, +1.8 percentage points, p = 0.19, to the prediction head being calibrated to training readers, transferring imperfectly to out-of-distribution readers.

cs.CL

ModuLoop : Low-Level Code Generation using Modular Synthesizer and Closed-Loop Debugger for Robotic Control

Large Language Models (LLMs) have demonstrated impressive performance across various domains, including code generation and problem solving. However, their application in robotic control, particularly in low-level tasks that require precise manipulation, real-time feedback, and environment-dependent execution, remains limited. To address this challenge, we propose the Closed-Loop Modular Code Synthesizer framework. This framework leverages a pre-trained LLM without any task-specific fine-tuning to perform modular code planning and generation, and iteratively executes the generated code while inserting debugging probes to observe its behavior. This closed-loop structure facilitates systematic debugging and refinement, ultimately producing executable control programs. We apply the proposed framework to the calibration of an RGB-D camera and a robotic arm, validating its effectiveness in real-world settings. Furthermore, through a subsequent pick-and-place task, we demonstrate not only the accuracy of the calibration but also the potential extensibility of the framework. Across both tasks, the framework achieved high execution accuracy and autonomy, illustrating the practicality and scalability of LLM-based robotic control using our framework.

cs.RO

Missing Pattern Recognized Diffusion Imputation Model for Missing Not At Random

Missing data frequently arises across diverse domains, including time-series and image domains. In the real world, missing occurrences often depend on the unobservable values themselves, which are referred to as Missing Not at Random (MNAR). In this work, we introduce the Missing Pattern Recognized Diffusion Imputation Model (PRDIM), a novel framework that explicitly captures the missing pattern and precisely imputes unobserved values. PRDIM iteratively maximizes the likelihood of the joint distribution for observed values and missing mask under an Expectation-Maximization (EM) algorithm. In this sense, we first employ a pattern recognizer, which approximates the underlying missing pattern and provides guidance during every inference toward more plausible imputations with respect to the missing information. Through extensive experiments, we demonstrate that PRDIM consistently achieves strong imputation performance under MNAR settings across multiple data modalities.

cs.LG

I'm Fine, But My Voice Isn't: Cross-Modal Affective Dissonance Detection for Reflective Journaling

Digital journaling creates an authenticity gap: users consciously translate raw emotions into text, often sanitizing narratives even in private writing. We formalize this as Cross-Modal Affective Dissonance Detection (CADD), a directional three-way classification distinguishing Masking (positive text, negative acoustics), Coping (negative text, positive acoustics), and Congruent utterances, grounded in Gross's process model of emotion regulation. We present three further contributions: (i) CADD-Journal, a 1,800-sample TTS dataset with a shared-sentence-pool design that provably isolates acoustic signal from textual content; (ii) DACM, a dual-encoder model with asymmetric cross-modal attention that re-solves a gradient degeneracy in pooled fusion, achieving macro-F1 0.711 - with a four-step ablation demonstrating that asymmetric attention is the dominant driver (+ 0.242) while the DIM is effective only on cross-modal features (+0.033); and (iii) a domain gap quantification: zero-shot evaluation across three naturalistic corpora reveals a substantial gap between TTS-trained models and real speech, and we identify two concrete requirements for future in-the-wild corpus construction. ReflectJournal, a proof-of-concept iOS application, operationalizes the framework and provides a deployment platform for naturalistic data collection.

cs.HC

Are You the A-hole? A Fair, Multi-Perspective Ethical Reasoning Framework

Standard methods for aggregating natural language judgments, such as majority voting, often fail to produce logically consistent results when applied to high-conflict domains, treating differing opinions as noise. We propose a neuro-symbolic aggregation framework that formalizes conflict resolution through Weighted Maximum Satisfiability (MaxSAT). Our pipeline utilizes a language model to map unstructured natural language explanations into interpretable logical predicates and confidence weights. These components are then encoded as soft constraints within the Z3 solver, transforming the aggregation problem into an optimization task that seeks the maximum consistency across conflicting testimony. Using the Reddit r/AmItheAsshole forum as a case study in large-scale moral disagreement, our system generates logically coherent verdicts that diverge from popularity-based labels 62% of the time, corroborated by an 86% agreement rate with independent human evaluators. This study demonstrates the efficacy of coupling neural semantic extraction with formal solvers to enforce logical soundness and explainability in the aggregation of noisy human reasoning.

cs.CL

NEMESIS: Noise-suppressed Efficient MAE with Enhanced Superpatch Integration Strategy

Volumetric CT imaging is essential for clinical diagnosis, yet annotating 3D volumes is expensive and time-consuming, motivating self-supervised learning (SSL) from unlabeled data. However, applying SSL to 3D CT remains challenging due to the high memory cost of full-volume transformers and the anisotropic spatial structure of CT data, which is not well captured by conventional masking strategies. We propose NEMESIS, a masked autoencoder (MAE) framework that operates on local 128x128x128 superpatches, enabling memory-efficient training while preserving anatomical detail. NEMESIS introduces three key components: (i) noise-enhanced reconstruction as a pretext task, (ii) Masked Anatomical Transformer Blocks (MATB) that perform dual-masking through parallel plane-wise and axis-wise token removal, and (iii) NEMESIS Tokens (NT) for cross-scale context aggregation. On the BTCV multi-organ classification benchmark, NEMESIS with a frozen backbone and a linear classifier achieves a mean AUROC of 0.9633, surpassing fully fine-tuned SuPreM (0.9493) and VoCo (0.9387). Under a low-label regime with only 10% of available annotations, it retains an AUROC of 0.9075, demonstrating strong label efficiency. Furthermore, the superpatch-based design reduces computational cost to 31.0 GFLOPs per forward pass, compared to 985.8 GFLOPs for the full-volume baseline, providing a scalable and robust foundation for 3D medical imaging.

cs.CV

MATHENA: Mamba-based Architectural Tooth Hierarchical Estimator and Holistic Evaluation Network for Anatomy

Dental diagnosis from Orthopantomograms (OPGs) requires coordination of tooth detection, caries segmentation (CarSeg), anomaly detection (AD), and dental developmental staging (DDS). We propose Mamba-based Architectural Tooth Hierarchical Estimator and Holistic Evaluation Network for Anatomy (MATHENA), a unified framework leveraging Mamba's linear-complexity State Space Models (SSM) to address all four tasks. MATHENA integrates MATHE, a multi-resolution SSM-driven detector with four-directional Vision State Space (VSS) blocks for O(N) global context modeling, generating per-tooth crops. These crops are processed by HENA, a lightweight Mamba-UNet with a triple-head architecture and Global Context State Token (GCST). In the triple-head architecture, CarSeg is first trained as an upstream task to establish shared representations, which are then frozen and reused for downstream AD fine-tuning and DDS classification via linear probing, enabling stable, efficient learning. We also curate PARTHENON, a benchmark comprising 15,062 annotated instances from ten datasets. MATHENA achieves 93.78% mAP@50 in tooth detection, 90.11% Dice for CarSeg, 88.35% for AD, and 72.40% ACC for DDS.

cs.CV

Mechanical anisotropy of 3D-printed digital materials at large strains

3D-printed digital materials whose mechanical behavior travels between those from thermoplastic to rubbery polymers have become increasingly important. However, their mechanical functionalities have not been fully exploited due to intrinsic mechanical anisotropy resulting from microstructural heterogeneity. Here, we combine mechanical testing, microscopy analysis and micromechanical modeling for a comprehensive understanding of complex deformation mechanisms responsible for the printing-orientation-dependent nonlinear mechanical behavior of digital materials at small to large strains. Towards this end, we construct representative volume elements that account for highly anisotropic microstructural features resulting from the printing-orientation-dependent diffusion and mixing between photocurable base resins. We then demonstrate, through micromechanical analysis, that stable compressive deformation of well-aligned elliptical hard thermoplastic inclusions embedded within the surrounding soft rubbery matrix gives rise to initial elastic anisotropy. Our experimental and micromechanical modeling results also show that the interplay between buckling instability and plastic deformation of the high-aspect-ratio hard domains governs mechanical anisotropy at large strains as well as the printing-orientation-dependent resilience and energy dissipation capabilities in these digital materials.

cond-mat.soft

Generalizable Slum Detection from Satellite Imagery with Mixture-of-Experts

Satellite-based slum segmentation holds significant promise in generating global estimates of urban poverty. However, the morphological heterogeneity of informal settlements presents a major challenge, hindering the ability of models trained on specific regions to generalize effectively to unseen locations. To address this, we introduce a large-scale high-resolution dataset and propose GRAM (Generalized Region-Aware Mixture-of-Experts), a two-phase test-time adaptation framework that enables robust slum segmentation without requiring labeled data from target regions. We compile a million-scale satellite imagery dataset from 12 cities across four continents for source training. Using this dataset, the model employs a Mixture-of-Experts architecture to capture region-specific slum characteristics while learning universal features through a shared backbone. During adaptation, prediction consistency across experts filters out unreliable pseudo-labels, allowing the model to generalize effectively to previously unseen regions. GRAM outperforms state-of-the-art baselines in low-resource settings such as African cities, offering a scalable and label-efficient solution for global slum mapping and data-driven urban planning.

cs.CV

Towards a Generalizable AI for Materials Discovery: Validation through Immersion Coolant Screening

Artificial intelligence (AI) has emerged as a powerful accelerator of materials discovery, yet most existing models remain problem-specific, requiring additional data collection and retraining for each new property. Here we introduce and validate GATE (Geometrically Aligned Transfer Encoder) -- a generalizable AI framework that jointly learns 34 physicochemical properties spanning thermal, electrical, mechanical, and optical domains. By aligning these properties within a shared geometric space, GATE captures cross-property correlations that reduce disjoint-property bias -- a key factor causing false positives in multi-criteria screening. To demonstrate its generalizable utility, GATE -- without any problem-specific model reconfiguration -- applied to the discovery of immersion cooling fluids for data centers, a stringent real-world challenge defined by the Open Compute Project (OCP). Screening billions of candidates, GATE identified 92,861 molecules as promising for practical deployment. Four were experimentally or literarily validated, showing strong agreement with wet-lab measurements and performance comparable to or exceeding a commercial coolant. These results establish GATE as a generalizable AI platform readily applicable across diverse materials discovery tasks.

cs.LG

Learning Multidimensional Urban Poverty Representation with Satellite Imagery

Recent advances in deep learning have enabled the inference of urban socioeconomic characteristics from satellite imagery. However, models relying solely on urbanization traits often show weak correlations with poverty indicators, as unplanned urban growth can obscure economic disparities and spatial inequalities. To address this limitation, we introduce a novel representation learning framework that captures multidimensional deprivation-related traits from very high-resolution satellite imagery for precise urban poverty mapping. Our approach integrates three complementary traits: (1) accessibility traits, learned via contrastive learning to encode proximity to essential infrastructure; (2) morphological traits, derived from building footprints to reflect housing conditions in informal settlements; and (3) economic traits, inferred from nightlight intensity as a proxy for economic activity. To mitigate spurious correlations - such as those from non-residential nightlight sources that misrepresent poverty conditions - we incorporate a backdoor adjustment mechanism that leverages morphological traits during training of the economic module. By fusing these complementary features into a unified representation, our framework captures the complex nature of poverty, which often diverges from economic development trends. Evaluations across three capital cities - Cape Town, Dhaka, and Phnom Penh - show that our model significantly outperforms existing baselines, offering a robust tool for poverty mapping and policy support in data-scarce regions.

cs.CY

ORCA: ORchestrating Causal Agent

Causal analysis on relational databases is challenging, as analysis datasets must be repeatedly queried from complex schemas. Recent LLM systems can automate individual steps, but they hardly manage dependencies across analysis stages, making it difficult to preserve consistency between causal hypothesis. We propose ORCA (ORchestrating Causal Agent), an interactive multi-agent framework to enable coherent causal analysis on relational databases by maintaining shared state and introducing human checkpoints. In a controlled user study, participants using ORCA successfully completed end-to-end analysis more often than with a baseline LLM (GPT-4o-mini) assistant by 42 percentage points, achieved substantially lower ATE error, and reduced time spent on repetitive data exploration and query refinement by 76\% on average. These results show that ORCA improves both how users interact with the causal analysis pipeline and the reliability of the resulting causal conclusions.

cs.DB

Score-informed Neural Operator for Enhancing Ordering-based Causal Discovery

Ordering-based approaches to causal discovery identify topological orders of causal graphs, providing scalable alternatives to combinatorial search methods. Under the Additive Noise Model (ANM) assumption, recent causal ordering methods based on score matching require an accurate estimation of the Hessian diagonal of the log-densities. In this paper, we aim to improve the approximation of the Hessian diagonal of the log-densities, thereby enhancing the performance of ordering-based causal discovery algorithms. Existing approaches that rely on Stein gradient estimators are computationally expensive and memory-intensive, while diffusion-model-based methods remain unstable due to the second-order derivatives of score models. To alleviate these problems, we propose Score-informed Neural Operator (SciNO), a probabilistic generative model in smooth function spaces designed to stably approximate the Hessian diagonal and to preserve structural information during the score modeling. Empirical results show that SciNO reduces order divergence by 42.7% on synthetic graphs and by 31.5% on real-world datasets on average compared to DiffAN, while maintaining memory efficiency and scalability. Furthermore, we propose a probabilistic control algorithm for causal reasoning with autoregressive models that integrates SciNO's probability estimates with autoregressive model priors, enabling reliable data-driven causal ordering informed by semantic information. Consequently, the proposed method enhances causal reasoning abilities of LLMs without additional fine-tuning or prompt engineering.

cs.LG

Interstitially bridged van der Waals interface enabling stacking-fault-free, layer-by-layer epitaxy

Van der Waals (vdW) crystals are prone to twisting, sliding, and buckling due to inherently weak interlayer interactions. While thickness-controlled vdW structures have attracted considerable attention as ultrathin semiconducting channels, the deterministic synthesis of stacking-fault-free multilayers remains a persistent challenge. Here, we report the epitaxial growth of single-crystalline hexagonal bilayer MoS 2 , enabled by the incorporation of Mo interstitials between layers during layer-by-layer deposition. The resulting bilayers exhibit exceptional structural robustness, maintaining their crystallinity and suppressing both rotational and translational interlayer misalignments even after transfer processes. Atomic-resolution analysis reveals that the Mo interstitials are located at a single sublattice site within the hexagonal lattice, where they form tetrahedral bonds with sulfur atoms from both MoS 2 layers, effectively anchoring the interlayer registry. Density functional theory calculations further indicate that these Mo atoms act as nucleation centers, promoting the selective formation of the hexagonal bilayer phase. This approach offers a robust strategy for the deterministic growth of multilayer vdW crystals with precisely controlled stacking order and enhanced interlayer coupling.

cond-mat.mtrl-sci

Geometric Embedding Alignment via Curvature Matching in Transfer Learning

Geometrical interpretations of deep learning models offer insightful perspectives into their underlying mathematical structures. In this work, we introduce a novel approach that leverages differential geometry, particularly concepts from Riemannian geometry, to integrate multiple models into a unified transfer learning framework. By aligning the Ricci curvature of latent space of individual models, we construct an interrelated architecture, namely Geometric Embedding Alignment via cuRvature matching in transfer learning (GEAR), which ensures comprehensive geometric representation across datapoints. This framework enables the effective aggregation of knowledge from diverse sources, thereby improving performance on target tasks. We evaluate our model on 23 molecular task pairs sourced from various domains and demonstrate significant performance gains over existing benchmark model under both random (14.4%) and scaffold (8.3%) data splits.

cs.LG

Modular Mechanism Design Optimization in Large-Scale Systems with Manufacturing Cost Considerations

Modular design maximizes utility by using standardized components in large-scale systems. From a manufacturing perspective, it supports green technology by reducing material waste and improving reusability. Industrially, it offers economic benefits through economies of scale, making it a practical design strategy. Typically, modularization selects a representative design from predefined candidates to meet all performance requirements. However, achieving effective modularization in mechanical mechanisms presents challenges. First, mechanisms depend on geometric relationships for functional motion, and varying loads lead to different optimal parameters, complicating representative design selection. Second, the chosen design often exceeds optimal parameters, causing over-specification and performance deviations, which worsen as scale increases. To address this, we propose a modular mechanism design framework using surrogate-based optimization. This approach finds optimal designs for large-scale systems and partitions them into groups, each assigned an optimized design. This multi-objective optimization (MOO) problem balances economies of scale and performance consistency. Unlike conventional methods based on predefined candidates and simple grouping, our framework optimizes design variables flexibly for modularization. Additionally, we analyze manufacturing cost parameters to develop a decision support system for selecting optimal strategies in diverse design scenarios. This enhances maintainability, improves interchangeability, and fosters environmentally sustainable manufacturing.

cs.ET

Trajectory-Class-Aware Multi-Agent Reinforcement Learning

In the context of multi-agent reinforcement learning, generalization is a challenge to solve various tasks that may require different joint policies or coordination without relying on policies specialized for each task. We refer to this type of problem as a multi-task, and we train agents to be versatile in this multi-task setting through a single training process. To address this challenge, we introduce TRajectory-class-Aware Multi-Agent reinforcement learning (TRAMA). In TRAMA, agents recognize a task type by identifying the class of trajectories they are experiencing through partial observations, and the agents use this trajectory awareness or prediction as additional information for action policy. To this end, we introduce three primary objectives in TRAMA: (a) constructing a quantized latent space to generate trajectory embeddings that reflect key similarities among them; (b) conducting trajectory clustering using these trajectory embeddings; and (c) building a trajectory-class-aware policy. Specifically for (c), we introduce a trajectory-class predictor that performs agent-wise predictions on the trajectory class; and we design a trajectory-class representation model for each trajectory class. Each agent takes actions based on this trajectory-class representation along with its partial observation for task-aware execution. The proposed method is evaluated on various tasks, including multi-task problems built upon StarCraft II. Empirical results show further performance improvements over state-of-the-art baselines.

cs.LG