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Molecular structure recognition is the task of translating a molecular image into its graph structure. Significant variation in drawing styles and conventions exhibited in chemical literature poses a significant challenge for automating…

Computer Vision and Pattern Recognition · Computer Science 2023-03-22 Yujie Qian , Jiang Guo , Zhengkai Tu , Zhening Li , Connor W. Coley , Regina Barzilay

Like many scientific fields, new chemistry literature has grown at a staggering pace, with thousands of papers released every month. A large portion of chemistry literature focuses on new molecules and reactions between molecules. Most…

Quantitative Methods · Quantitative Biology 2021-09-10 Daniel Campos , Heng Ji

Chemical representation learning has gained increasing interest due to the limited availability of supervised data in fields such as drug and materials design. This interest particularly extends to chemical language representation learning,…

Chemical Physics · Physics 2024-08-06 Jun-Hyung Park , Yeachan Kim , Mingyu Lee , Hyuntae Park , SangKeun Lee

Deep-learning algorithms enable precise image recognition based on high-dimensional hierarchical image features. Here, we report the development and implementation of a deep-learning-based image segmentation algorithm in an autonomous…

Image and Video Processing · Electrical Eng. & Systems 2020-03-26 Satoru Masubuchi , Eisuke Watanabe , Yuta Seo , Shota Okazaki , Takao Sasagawa , Kenji Watanabe , Takashi Taniguchi , Tomoki Machida

Multimodal Large Language Models (MLLMs) have shown strong performance in document image tasks, especially Optical Character Recognition (OCR). However, they struggle with Document Image Machine Translation (DIMT), which requires handling…

Computation and Language · Computer Science 2025-07-14 Yupu Liang , Yaping Zhang , Zhiyang Zhang , Zhiyuan Chen , Yang Zhao , Lu Xiang , Chengqing Zong , Yu Zhou

For several decades, chemical knowledge has been published in written text, and there have been many attempts to make it accessible, for example, by transforming such natural language text to a structured format. Although the discovered…

Computer Vision and Pattern Recognition · Computer Science 2022-02-22 Sanghyun Yoo , Ohyun Kwon , Hoshik Lee

AI models for drug discovery and chemical literature mining must interpret molecular images and generate outputs consistent with 3D geometry and stereochemistry. Most molecular language models rely on strings or graphs, while…

Computer Vision and Pattern Recognition · Computer Science 2026-01-22 Jing Lan , Hexiao Ding , Hongzhao Chen , Yufeng Jiang , Nga-Chun Ng , Gwing Kei Yip , Gerald W. Y. Cheng , Yunlin Mao , Jing Cai , Liang-ting Lin , Jung Sun Yoo

Scanning electron microscopy (SEM) is indispensable in diverse applications ranging from microelectronics to food processing because it provides large depth-of-field images with a resolution beyond the optical diffraction limit. However,…

We present DeepSeek-VL2, an advanced series of large Mixture-of-Experts (MoE) Vision-Language Models that significantly improves upon its predecessor, DeepSeek-VL, through two key major upgrades. For the vision component, we incorporate a…

Most molecular diagram parsers recover chemical structure from raster images (e.g., PNGs). However, many PDFs include commands giving explicit locations and shapes for characters, lines, and polygons. We present a new parser that uses these…

Computer Vision and Pattern Recognition · Computer Science 2025-02-27 Ayush Kumar Shah , Bryan Manrique Amador , Abhisek Dey , Ming Creekmore , Blake Ocampo , Scott Denmark , Richard Zanibbi

We present FireRed-OCR, a systematic framework to specialize general VLMs into high-performance OCR models. Large Vision-Language Models (VLMs) have demonstrated impressive general capabilities but frequently suffer from ``structural…

Scoring the Optical Character Recognition (OCR) capabilities of Large Multimodal Models (LMMs) has witnessed growing interest. Existing benchmarks have highlighted the impressive performance of LMMs in text recognition; however, their…

Automatically extracting chemical structures from documents is essential for the large-scale analysis of the literature in chemistry. Automatic pipelines have been developed to recognize molecules represented either in figures or in text…

Computer Vision and Pattern Recognition · Computer Science 2026-03-31 Tim Strohmeyer , Lucas Morin , Gerhard Ingmar Meijer , Valéry Weber , Ahmed Nassar , Peter Staar

We propose an end-to-end recurrent encoder-decoder based sequence learning approach for printed text Optical Character Recognition (OCR). In contrast to present day existing state-of-art OCR solution which uses connectionist temporal…

Computer Vision and Pattern Recognition · Computer Science 2015-12-29 Devendra Kumar Sahu , Mohak Sukhwani

The automatic recognition of tabular data in document images presents a significant challenge due to the diverse range of table styles and complex structures. Tables offer valuable content representation, enhancing the predictive…

Computer Vision and Pattern Recognition · Computer Science 2024-04-22 Avinash Anand , Raj Jaiswal , Pijush Bhuyan , Mohit Gupta , Siddhesh Bangar , Md. Modassir Imam , Rajiv Ratn Shah , Shin'ichi Satoh

The extraction of molecular structures and reaction data from scientific documents is challenging due to their varied, unstructured chemical formats and complex document layouts. To address this, we introduce MolMole, a vision-based deep…

Molecular property prediction is an increasingly critical task within drug discovery and development. Typically, neural networks can learn molecular properties using graph-based, language-based or feature-based methods. Recent advances in…

Machine Learning · Computer Science 2025-07-31 Philip Spence , Brooks Paige , Anne Osbourn

Most deep learning-based super-resolution (SR) methods are not image-specific: 1) They are trained on samples synthesized by predefined degradations (e.g. bicubic downsampling), regardless of the domain gap between training and testing…

Computer Vision and Pattern Recognition · Computer Science 2022-03-16 Shang Li , Guixuan Zhang , Zhengxiong Luo , Jie Liu , Zhi Zeng , Shuwu Zhang

In recent years, deep learning models have revolutionized medical image interpretation, offering substantial improvements in diagnostic accuracy. However, these models often struggle with challenging images where critical features are…

Computer Vision and Pattern Recognition · Computer Science 2023-07-03 Pradeep Singh , Kishore Babu Nampalle , Uppala Vivek Narayan , Balasubramanian Raman

Optical Character Recognition (OCR) is a fundamental task for digitizing information, serving as a critical bridge between visual data and textual understanding. While modern Vision-Language Models (VLM) have achieved high accuracy in this…

Computer Vision and Pattern Recognition · Computer Science 2026-05-28 Sean Man , Gilad Deutch , Roy Ganz , Roi Ronen , Shahar Tsiper , Shai Mazor , Niv Nayman