English
Related papers

Related papers: Gotta be SAFE: A New Framework for Molecular Desig…

200 papers

A single biomedical image can be meaningfully segmented in multiple ways, depending on the desired application. For instance, a brain MRI can be segmented according to tissue types, vascular territories, broad anatomical regions,…

Computer Vision and Pattern Recognition · Computer Science 2025-12-16 Marianne Rakic , Siyu Gai , Etienne Chollet , John V. Guttag , Adrian V. Dalca

In this work, we present SEEM, a promptable and interactive model for segmenting everything everywhere all at once in an image, as shown in Fig.1. In SEEM, we propose a novel decoding mechanism that enables diverse prompting for all types…

Computer Vision and Pattern Recognition · Computer Science 2023-07-13 Xueyan Zou , Jianwei Yang , Hao Zhang , Feng Li , Linjie Li , Jianfeng Wang , Lijuan Wang , Jianfeng Gao , Yong Jae Lee

Designing safe and sustainable chemicals is critical to combat chemical pollution in our environment. Machine learning (ML) methods have been developed to aid with de novo molecule design. However, data on the environmental impacts of…

Human-Computer Interaction · Computer Science 2026-05-18 Coelina Robinson , Franziska Weissbach , Kjell Jorner , Mennatallah El-Assady , Christina Humer

Electroencephalogram (EEG)-based brain-computer interfaces (BCIs) are widely adopted due to their efficiency and portability; however, their decoding algorithms still face multiple challenges, including inadequate generalization,…

Human-Computer Interaction · Computer Science 2026-01-12 Tianwang Jia , Xiaoqing Chen , Dongrui Wu

Federated semantic segmentation enables pixel-level classification in images through collaborative learning while maintaining data privacy. However, existing research commonly overlooks the fine-grained class relationships within the…

Computer Vision and Pattern Recognition · Computer Science 2025-05-15 Xiaoyang Yu , Xiaoming Wu , Xin Wang , Dongrun Li , Ming Yang , Peng Cheng

Semantic segmentation is a crucial task in medical imaging. Although supervised learning techniques have proven to be effective in performing this task, they heavily depend on large amounts of annotated training data. The recently…

Computer Vision and Pattern Recognition · Computer Science 2024-11-20 Ron Keuth , Lasse Hansen , Maren Balks , Ronja Jäger , Anne-Nele Schröder , Ludger Tüshaus , Mattias Heinrich

Spectral Embedding (SE) has often been used to map data points from non-linear manifolds to linear subspaces for the purpose of classification and clustering. Despite significant advantages, the subspace structure of data in the original…

Computer Vision and Pattern Recognition · Computer Science 2023-05-16 Hira Yaseen , Arif Mahmood

Despite the great success of word embedding, sentence embedding remains a not-well-solved problem. In this paper, we present a supervised learning framework to exploit sentence embedding for the medical question answering task. The learning…

Computation and Language · Computer Science 2018-11-16 Yu Hao , Xien Liu , Ji Wu , Ping Lv

A new ensemble framework for interpretable model called Linear Iterative Feature Embedding (LIFE) has been developed to achieve high prediction accuracy, easy interpretation and efficient computation simultaneously. The LIFE algorithm is…

Machine Learning · Statistics 2021-03-19 Agus Sudjianto , Jinwen Qiu , Miaoqi Li , Jie Chen

Effectively capturing graph node sequences in the form of vector embeddings is critical to many applications. We achieve this by (i) first learning vector embeddings of single graph nodes and (ii) then composing them to compactly represent…

Machine Learning · Computer Science 2019-11-11 Swati Rallapalli , Liang Ma , Mudhakar Srivatsa , Ananthram Swami , Heesung Kwon , Graham Bent , Christopher Simpkin

Accurate segmentation of tissues and instruments in surgical scenes is annotation-intensive due to irregular shapes, thin structures, specularities, and frequent occlusions. While SAM models support point, box, and mask prompts, points are…

Image and Video Processing · Electrical Eng. & Systems 2026-03-20 Haonan Ping , Jian Jiang , Cheng Yuan , Qizhen Sun , Lv Wu , Yutong Ban

Based on the traditional VAE, a novel neural network model is presented, with the latest molecular representation, SELFIES, to improve the effect of generating new molecules. In this model, multi-layer convolutional network and Fisher…

Biomolecules · Quantitative Biology 2023-05-03 Li Kai , Li Ning , Zhang Wei , Gao Ming

In deep learning for drug discovery, chemical data are often represented as simplified molecular-input line-entry system (SMILES) sequences which allow for straightforward implementation of natural language processing methodologies, one…

Machine Learning · Computer Science 2023-10-05 Kathryn E. Kirchoff , Travis Maxfield , Alexander Tropsha , Shawn M. Gomez

When translating UI design prototypes to code in industry, automatically generating code from design prototypes can expedite the development of applications and GUI iterations. However, in design prototypes without strict design…

Software Engineering · Computer Science 2023-09-19 Liuqing Chen , Yunnong Chen , Shuhong Xiao , Yaxuan Song , Lingyun Sun , Yankun Zhen , Tingting Zhou , Yanfang Chang

The current state-of-the-art image-sentence retrieval methods implicitly align the visual-textual fragments, like regions in images and words in sentences, and adopt attention modules to highlight the relevance of cross-modal semantic…

Computer Vision and Pattern Recognition · Computer Science 2021-08-06 Xuri Ge , Fuhai Chen , Joemon M. Jose , Zhilong Ji , Zhongqin Wu , Xiao Liu

Traditional feature engineering approaches for molecular sequence classification suffer from sparsity issues and computational complexity, while deep learning models often underperform on tabular biological data. This paper introduces a…

Machine Learning · Computer Science 2025-12-12 Sarwan Ali , Taslim Murad , Imdadullah Khan

Molecular representation learning has become a central approach in AI-driven drug discovery, yet existing molecular tokenizations such as SMILES remain largely syntactic and do not naturally align with chemically meaningful substructures.…

Machine Learning · Computer Science 2026-05-19 Takayuki Kimura

Quantum machine learning (QML) has great potential for the analysis of chemical datasets. However, conventional quantum data-encoding schemes, such as fingerprint encoding, are generally unfeasible for the accurate representation of…

Quantum Physics · Physics 2025-11-18 Choy Boy , Edoardo Altamura , Dilhan Manawadu , Ivano Tavernelli , Stefano Mensa , David J. Wales

Molecule generation is key to drug discovery and materials science, enabling the design of novel compounds with specific properties. Large language models (LLMs) can learn to perform a wide range of tasks from just a few examples. However,…

Computation and Language · Computer Science 2025-09-30 Wen Tao , Jing Tang , Alvin Chan , Bryan Hooi , Baolong Bi , Nanyun Peng , Yuansheng Liu , Yiwei Wang

Promptable foundation models such as the Segment Anything Model (SAM) produce high-quality masks but remain semantically blind, relying on external prompts to specify categories. Existing vision-language approaches address this limitation…

Computer Vision and Pattern Recognition · Computer Science 2026-05-26 Shayan Jalilian , Abdul Bais
‹ Prev 1 4 5 6 7 8 10 Next ›