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We introduce Causal Operator with Adaptive Solver Transformer (COAST), a novel neural operator learning method that leverages a causal language model (CLM) framework to dynamically adapt time steps. Our method predicts both the evolution of a system and its optimal time step, intelligently balancing computational efficiency and accuracy. We find that COAST generates variable step sizes that correlate with the underlying system intrinsicities, both within and across dynamical systems. Within a single trajectory, smaller steps are taken in regions of high complexity, while larger steps are employed in simpler regions. Across different systems, more complex dynamics receive more granular time steps. Benchmarked on diverse systems with varied dynamics, COAST consistently outperforms state-of-the-art methods, achieving superior performance in both efficiency and accuracy. This work underscores the potential of CLM-based intelligent adaptive solvers for scalable operator learning of dynamical systems.

In this paper, we study a new class of high-rate spatially coupled LDPC (SC-LDPC) codes based on the convolutional self-orthogonal codes (CSOCs) first introduced by Massey. The SC-LDPC codes are constructed by treating the irregular graph corresponding to the parity-check matrix of a systematic rate R = (n - 1)/n CSOC as a convolutional protograph. The protograph can then be lifted using permutation matrices to generate a high-rate SC-LDPC code whose strength depends on the lifting factor. The SC-LDPC codes constructed in this fashion can be decoded using iterative belief propagation (BP) based sliding window decoding (SWD). A non-systematic version of a CSOC parity-check matrix is then proposed by making a slight modification to the systematic construction. The non-systematic parity-check matrix corresponds to a regular protograph whose degree profile depends on the rate and error-correcting capability of the underlying CSOC. Even though the parity-check matrix is in non-systematic form, we show how systematic encoding can still be performed. We also show that the non-systematic convolutional protograph has a guaranteed girth and free distance and that these properties carry over to the lifted versions. Finally, numerical results are included demonstrating that CSOC-based SC-LDPC codes (i) achieve excellent performance at very high rates, (ii) have performance at least as good as that of SC-LDPC codes constructed from convolutional protographs commonly found in the literature, and (iii) have iterative decoding thresholds comparable to those of existing SC-LDPC code designs.

With the development of artificial intelligence, simulation-based optimization problems, which present a significant challenge in the process systems engineering community, are increasingly being addressed with the surrogate-based framework. In this work, we propose a deterministic algorithm framework based on feasible path sequential quadratic programming for optimizing differentiable machine learning models embedded problems. The proposed framework effectively addresses two key challenges: (i) achieving the computation of first- and second-order derivatives of machine learning models' outputs with respect to inputs; and (ii) by introducing the feasible path method, the massive intermediate variables resulting from the algebraic formulation of machine learning models eliminated. Surrogate models for six test functions and two process simulations were established and optimized. All six test functions were successfully optimized to the global optima, demonstrating the framework's effectiveness. The optimization time for all cases did not exceed 2s, highlighting the efficiency of the algorithm.

Designing synthetic routes for novel molecules is pivotal in various fields like medicine and chemistry. In this process, researchers need to explore a set of synthetic reactions to transform starting molecules into intermediates step by step until the target novel molecule is obtained. However, designing synthetic routes presents challenges for researchers. First, researchers need to make decisions among numerous possible synthetic reactions at each step, considering various criteria (e.g., yield, experimental duration, and the count of experimental steps) to construct the synthetic route. Second, they must consider the potential impact of one choice at each step on the overall synthetic route. To address these challenges, we proposed SynthLens, a visual analytics system to facilitate the iterative construction of synthetic routes by exploring multiple possibilities for synthetic reactions at each step of construction. Specifically, we have introduced a tree-form visualization in SynthLens to compare and evaluate all the explored routes at various exploration steps, considering both the exploration step and multiple criteria. Our system empowers researchers to consider their construction process comprehensively, guiding them toward promising exploration directions to complete the synthetic route. We validated the usability and effectiveness of SynthLens through a quantitative evaluation and expert interviews, highlighting its role in facilitating the design process of synthetic routes. Finally, we discussed the insights of SynthLens to inspire other multi-criteria decision-making scenarios with visual analytics.

Interactive Medical Image Segmentation (IMIS) has long been constrained by the limited availability of large-scale, diverse, and densely annotated datasets, which hinders model generalization and consistent evaluation across different models. In this paper, we introduce the IMed-361M benchmark dataset, a significant advancement in general IMIS research. First, we collect and standardize over 6.4 million medical images and their corresponding ground truth masks from multiple data sources. Then, leveraging the strong object recognition capabilities of a vision foundational model, we automatically generated dense interactive masks for each image and ensured their quality through rigorous quality control and granularity management. Unlike previous datasets, which are limited by specific modalities or sparse annotations, IMed-361M spans 14 modalities and 204 segmentation targets, totaling 361 million masks-an average of 56 masks per image. Finally, we developed an IMIS baseline network on this dataset that supports high-quality mask generation through interactive inputs, including clicks, bounding boxes, text prompts, and their combinations. We evaluate its performance on medical image segmentation tasks from multiple perspectives, demonstrating superior accuracy and scalability compared to existing interactive segmentation models. To facilitate research on foundational models in medical computer vision, we release the IMed-361M and model at https://github.com/uni-medical/IMIS-Bench.

Geological carbon sequestration (GCS) involves injecting CO$_2$ into subsurface geological formations for permanent storage. Numerical simulations could guide decisions in GCS projects by predicting CO$_2$ migration pathways and the pressure distribution in storage formation. However, these simulations are often computationally expensive due to highly coupled physics and large spatial-temporal simulation domains. Surrogate modeling with data-driven machine learning has become a promising alternative to accelerate physics-based simulations. Among these, the Fourier neural operator (FNO) has been applied to three-dimensional synthetic subsurface models. Here, to further improve performance, we have developed a nested Fourier-DeepONet by combining the expressiveness of the FNO with the modularity of a deep operator network (DeepONet). This new framework is twice as efficient as a nested FNO for training and has at least 80% lower GPU memory requirement due to its flexibility to treat temporal coordinates separately. These performance improvements are achieved without compromising prediction accuracy. In addition, the generalization and extrapolation ability of nested Fourier-DeepONet beyond the training range has been thoroughly evaluated. Nested Fourier-DeepONet outperformed the nested FNO for extrapolation in time with more than 50% reduced error. It also exhibited good extrapolation accuracy beyond the training range in terms of reservoir properties, number of wells, and injection rate.

Palmprint recognition has emerged as a prominent biometric authentication method, owing to its high discriminative power and user-friendly nature. This paper introduces a novel Cross-Chirality Palmprint Verification (CCPV) framework that challenges the conventional wisdom in traditional palmprint verification systems. Unlike existing methods that typically require storing both left and right palmprints, our approach enables verification using either palm while storing only one palmprint template. The core of our CCPV framework lies in a carefully designed matching rule. This rule involves flipping both the gallery and query palmprints and calculating the average distance between each pair as the final matching distance. This approach effectively reduces matching variance and enhances overall system robustness. We introduce a novel cross-chirality loss function to construct a discriminative and robust cross-chirality feature space. This loss enforces representation consistency across four palmprint variants: left, right, flipped left, and flipped right. The resulting compact feature space, coupled with the model's enhanced discriminative representation capability, ensures robust performance across various scenarios. We conducted extensive experiments to validate the efficacy of our proposed method. The evaluation encompassed multiple public datasets and considered both closed-set and open-set settings. The results demonstrate the CCPV framework's effectiveness and highlight its potential for real-world applications in palmprint authentication systems.

Recently, finger knuckle prints (FKPs) have gained attention due to their rich textural patterns, positioning them as a promising biometric for identity recognition. Prior FKP recognition methods predominantly leverage first-order feature descriptors, which capture intricate texture details but fail to account for structural information. Emerging research, however, indicates that second-order textures, which describe the curves and arcs of the textures, encompass this overlooked structural information. This paper introduces a novel FKP recognition approach, the Dual-Order Texture Competition Network (DOTCNet), designed to capture texture information in FKP images comprehensively. DOTCNet incorporates three dual-order texture competitive modules (DTCMs), each targeting textures at different scales. Each DTCM employs a learnable texture descriptor, specifically a learnable Gabor filter (LGF), to extract texture features. By leveraging LGFs, the network extracts first and second order textures to describe fine textures and structural features thoroughly. Furthermore, an attention mechanism enhances relevant features in the first-order features, thereby highlighting significant texture details. For second-order features, a competitive mechanism emphasizes structural information while reducing noise from higher-order features. Extensive experimental results reveal that DOTCNet significantly outperforms several standard algorithms on the publicly available PolyU-FKP dataset.

Automated cephalometric landmark detection is crucial in real-world orthodontic diagnosis. Current studies mainly focus on only adult subjects, neglecting the clinically crucial scenario presented by adolescents whose landmarks often exhibit significantly different appearances compared to adults. Hence, an open question arises about how to develop a unified and effective detection algorithm across various age groups, including adolescents and adults. In this paper, we propose CeLDA, the first work for Cephalometric Landmark Detection across Ages. Our method leverages a prototypical network for landmark detection by comparing image features with landmark prototypes. To tackle the appearance discrepancy of landmarks between age groups, we design new strategies for CeLDA to improve prototype alignment and obtain a holistic estimation of landmark prototypes from a large set of training images. Moreover, a novel prototype relation mining paradigm is introduced to exploit the anatomical relations between the landmark prototypes. Extensive experiments validate the superiority of CeLDA in detecting cephalometric landmarks on both adult and adolescent subjects. To our knowledge, this is the first effort toward developing a unified solution and dataset for cephalometric landmark detection across age groups. Our code and dataset will be made public on https://github.com/ShanghaiTech-IMPACT/Cephalometric-Landmark-Detection-across-Ages-with-Prototypical-Network, Comment: MICCAI 2024

Computational notebooks are widely utilized for exploration and analysis. However, creating slides to communicate analysis results from these notebooks is quite tedious and time-consuming. Researchers have proposed automatic systems for generating slides from notebooks, which, however, often do not consider the process of users conceiving and organizing their messages from massive code cells. Those systems ask users to go directly into the slide creation process, which causes potentially ill-structured slides and burdens in further refinement. Inspired by the common and widely recommended slide creation practice: drafting outlines first and then adding concrete content, we introduce OutlineSpark, an AI-powered slide creation tool that generates slides from a slide outline written by the user. The tool automatically retrieves relevant notebook cells based on the outlines and converts them into slide content. We evaluated OutlineSpark with 12 users. Both the quantitative and qualitative feedback from the participants verify its effectiveness and usability., Comment: To appear in Proceedings of the CHI Conference on Human Factors in Computing Systems (CHI 2024)