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Semantic image synthesis (SIS) refers to the problem of generating realistic imagery given a semantic segmentation mask that defines the spatial layout of object classes. Most of the approaches in the literature, other than the quality of…

Computer Vision and Pattern Recognition · Computer Science 2023-07-12 Tomaso Fontanini , Claudio Ferrari , Massimo Bertozzi , Andrea Prati

As a cornerstone of the modern digital economy, 3D modeling and rendering demand substantial resources and manual effort when scene editing is performed in the traditional manner. Despite recent progress in VLM-based agents for 3D editing,…

Human-Computer Interaction · Computer Science 2026-01-13 Hao Wang , Wenhui Zhu , Shao Tang , Zhipeng Wang , Xuanzhao Dong , Xin Li , Xiwen Chen , Ashish Bastola , Xinhao Huang , Yalin Wang , Abolfazl Razi

Engineering analysis automation in product development relies on rigid interfaces between tools, data formats and documented processes. When these interfaces change, as they routinely do as the product evolves in the engineering ecosystem,…

Software Engineering · Computer Science 2026-03-18 Alejandro Pradas-Gomez , Arindam Brahma , Ola Isaksson

We present ScienceClaw + Infinite, a framework for autonomous scientific investigation in which independent agents conduct research without central coordination, and any contributor can deploy new agents into a shared ecosystem. The system…

Artificial Intelligence · Computer Science 2026-03-17 Fiona Y. Wang , Lee Marom , Subhadeep Pal , Rachel K. Luu , Wei Lu , Jaime A. Berkovich , Markus J. Buehler

Recent advancements in computational chemistry have leveraged the power of trans-former-based language models, such as MoLFormer, pre-trained using a vast amount of simplified molecular-input line-entry system (SMILES) sequences, to…

Biomolecules · Quantitative Biology 2024-11-05 Tianhao Peng , Yuchen Li , Xuhong Li , Jiang Bian , Zeke Xie , Ning Sui , Shahid Mumtaz , Yanwu Xu , Linghe Kong , Haoyi Xiong

Materials science workflows rely on structured and unstructured data from the vast body of available scientific literature. However, most of the experimental details remain buried in text, tables, graphs and figures. Thus, constructing…

Computation and Language · Computer Science 2026-05-07 Achuth Chandrasekhar , Omid Barati Farimani , Radheesh Sharma Meda , Amir Barati Farimani

Geometric analyses of large language model (LLM) representations reveal structured variation across depth but remain fundamentally correlational with respect to token prediction formation. Meanwhile, causal interventions expose…

Machine Learning · Computer Science 2026-05-27 Shahar Haim , Daniel C McNamee

Capturing the structural changes that molecules undergo during chemical reactions in real space and time is a long-standing dream and an essential prerequisite for understanding and ultimately controlling femtochemistry. A key approach to…

We consider molecule generation in 3D space using language models (LMs), which requires discrete tokenization of 3D molecular geometries. Although tokenization of molecular graphs exists, that for 3D geometries is largely unexplored. Here,…

Artificial Intelligence · Computer Science 2024-08-20 Xiner Li , Limei Wang , Youzhi Luo , Carl Edwards , Shurui Gui , Yuchao Lin , Heng Ji , Shuiwang Ji

We propose EMMA, an efficient and unified architecture for multimodal understanding, generation and editing. Specifically, EMMA primarily consists of 1) An efficient autoencoder with a 32x compression ratio, which significantly reduces the…

Computer Vision and Pattern Recognition · Computer Science 2025-12-16 Xin He , Longhui Wei , Jianbo Ouyang , Minghui Liao , Lingxi Xie , Qi Tian

Formal/symbolic semantics can provide canonical, rigid controllability and interpretability to sentence representations due to their \textit{localisation} or \textit{composition} property. How can we deliver such property to the current…

Computation and Language · Computer Science 2025-07-02 Yingji Zhang , Danilo S. Carvalho , André Freitas

We consider the conditional generation of 3D drug-like molecules with \textit{explicit control} over molecular properties such as drug-like properties (e.g., Quantitative Estimate of Druglikeness or Synthetic Accessibility score) and…

Machine Learning · Computer Science 2024-12-20 Haoran Liu , Youzhi Luo , Tianxiao Li , James Caverlee , Martin Renqiang Min

LLM/VLM-based digital agents have advanced rapidly thanks to scalable sandboxes for coding, web navigation, and computer use, which provide rich interactive training grounds. In contrast, embodied agents still lack abundant, diverse, and…

Artificial Intelligence · Computer Science 2026-05-14 Haoqiang Kang , Xiaokang Ye , Yuhan Liu , Siddhant Hitesh Mantri , Lingjun Mao , James Fleming , Drishti Regmi , Lianhui Qin

We present GELATO -- the first language-driven trajectory reshaping framework to embed geometric environment awareness and multi-agent feedback orchestration to support multi-instruction in human-robot interaction scenarios. Unlike prior…

Robotics · Computer Science 2025-11-17 Junhui Huang , Yuhe Gong , Changsheng Li , Xingguang Duan , Luis Figueredo

The rapid advancement of large language models (LLMs) has significantly enhanced the capabilities of AI-driven agents across various tasks. However, existing agentic systems, whether based on fixed pipeline algorithms or pre-defined…

Artificial Intelligence · Computer Science 2025-06-03 Xunjian Yin , Xinyi Wang , Liangming Pan , Li Lin , Xiaojun Wan , William Yang Wang

The introduction of genome engineering technology has transformed biomedical research, making it possible to make precise changes to genetic information. However, creating an efficient gene-editing system requires a deep understanding of…

Markerless motion capture is making quantitative movement analysis increasingly accessible, yet analyzing the resulting data remains a barrier for clinicians without programming expertise. We present BiomechAgent, a code-generating AI agent…

Computation and Language · Computer Science 2026-02-10 R. James Cotton , Thomas Leonard

Designing realistic multi-object scenes requires not only generating images, but also planning spatial layouts that respect semantic relations and physical plausibility. On one hand, while recent advances in diffusion models have enabled…

Computer Vision and Pattern Recognition · Computer Science 2025-09-30 Zezhong Fan , Xiaohan Li , Luyi Ma , Kai Zhao , Liang Peng , Topojoy Biswas , Evren Korpeoglu , Kaushiki Nag , Kannan Achan

Large Language Models (LLMs) can generate Computer-Aided Design (CAD), yet lack physical comprehension required for reliable engineering design. Instead of attempting to implicitly learn physical laws from data, we propose a Hybrid…

Computer Vision and Pattern Recognition · Computer Science 2026-05-20 Elias Berger , Muhammad Usama , Jan Mehlstäubl , Bernhard Saske , Kristin Paetzold-Byhain

Large language models (LLMs) have emerged as powerful tools in chemistry, significantly impacting molecule design, property prediction, and synthesis optimization. This review highlights LLM capabilities in these domains and their potential…

Machine Learning · Computer Science 2024-11-18 Mayk Caldas Ramos , Christopher J. Collison , Andrew D. White
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