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Predicting drug response in patients from preclinical data remains a major challenge in precision oncology due to the substantial biological gap between in vitro cell lines and patient tumors. Rather than aiming to improve absolute in vitro…

Machine Learning · Computer Science 2026-03-18 Camille Jimenez Cortes , Philippe Lalanda , German Vega

The accurate prediction of drug responses remains a formidable challenge, particularly at the single-cell level and in clinical treatment contexts. Some studies employ transfer learning techniques to predict drug responses in individual…

Machine Learning · Computer Science 2025-06-03 Ran Song , Yinpu Bai , Hui Liu

The rise of single-cell sequencing technologies has revolutionized the exploration of drug resistance, revealing the crucial role of cellular heterogeneity in advancing precision medicine. By building computational models from existing…

Genomics · Quantitative Biology 2025-02-05 Yu-An Huang , Xiyue Cao , Zhu-Hong You , Yue-Chao Li , Xuequn Shang , Zhi-An Huang

Drug resistance presents a major challenge in cancer therapy. Single cell profiling offers insights into cellular heterogeneity, yet the application of large-scale foundation models for predicting drug response in single cell data remains…

Artificial Intelligence · Computer Science 2025-05-12 Qing Wang , Yining Pan , Minghao Zhou , Zijia Tang , Yanfei Wang , Guangyu Wang , Qianqian Song

AI-driven drug response prediction holds great promise for advancing personalized cancer treatment. However, the inherent heterogenity of cancer and high cost of data generation make accurate prediction challenging. In this study, we…

Machine Learning · Computer Science 2025-05-14 Till Rossner , Ziteng Li , Jonas Balke , Nikoo Salehfard , Tom Seifert , Ming Tang

Accurate and robust drug response prediction is of utmost importance in precision medicine. Although many models have been developed to utilize the representations of drugs and cancer cell lines for predicting cancer drug responses (CDR),…

Quantitative Methods · Quantitative Biology 2023-11-22 Xiaoqiong Xia , Chaoyu Zhu , Yuqi Shan , Fan Zhong , Lei Liu

Multi-source domain adaptation (MSDA) plays an important role in industrial model generalization. Recent efforts on MSDA focus on enhancing multi-domain distributional alignment while omitting three issues, e.g., the class-level discrepancy…

Machine Learning · Computer Science 2024-12-24 Min Huang , Zifeng Xie , Bo Sun , Ning Wang

Semi-supervised domain adaptation (SSDA) adapts a learner to a new domain by effectively utilizing source domain data and a few labeled target samples. It is a practical yet under-investigated research topic. In this paper, we analyze the…

Computer Vision and Pattern Recognition · Computer Science 2023-03-31 Wenqiao Zhang , Changshuo Liu , Can Cui , Beng Chin Ooi

Most existing domain adaptation methods focus on adaptation from only one source domain, however, in practice there are a number of relevant sources that could be leveraged to help improve performance on target domain. We propose a novel…

Computer Vision and Pattern Recognition · Computer Science 2021-08-02 Ruihuang Li , Xu Jia , Jianzhong He , Shuaijun Chen , Qinghua Hu

With the rapid development of high-throughput technologies, parallel acquisition of large-scale drug-informatics data provides huge opportunities to improve pharmaceutical research and development. One significant application is the purpose…

Machine Learning · Computer Science 2018-10-03 Lingwei Xie , Song He , Shu Yang , Boyuan Feng , Kun Wan , Zhongnan Zhang , Xiaochen Bo , Yufei Ding

We propose an active learning approach for transferring representations across domains. Our approach, active adversarial domain adaptation (AADA), explores a duality between two related problems: adversarial domain alignment and importance…

Computer Vision and Pattern Recognition · Computer Science 2020-03-11 Jong-Chyi Su , Yi-Hsuan Tsai , Kihyuk Sohn , Buyu Liu , Subhransu Maji , Manmohan Chandraker

Multi-source unsupervised domain adaptation (MS-UDA) for sentiment analysis (SA) aims to leverage useful information in multiple source domains to help do SA in an unlabeled target domain that has no supervised information. Existing…

Computation and Language · Computer Science 2020-06-11 Yong Dai , Jian Liu , Xiancong Ren , Zenglin Xu

While domain adaptation has been actively researched in recent years, most theoretical results and algorithms focus on the single-source-single-target adaptation setting. Naive application of such algorithms on multiple source domain…

Machine Learning · Computer Science 2017-10-31 Han Zhao , Shanghang Zhang , Guanhang Wu , João P. Costeira , José M. F. Moura , Geoffrey J. Gordon

Supervised learning is constrained by the availability of labeled data, which are especially expensive to acquire in the field of digital pathology. Making use of open-source data for pre-training or using domain adaptation can be a way to…

Computer Vision and Pattern Recognition · Computer Science 2022-01-20 Christian Abbet , Linda Studer , Andreas Fischer , Heather Dawson , Inti Zlobec , Behzad Bozorgtabar , Jean-Philippe Thiran

Recent advances in deep domain adaptation reveal that adversarial learning can be embedded into deep networks to learn transferable features that reduce distribution discrepancy between the source and target domains. Existing domain…

Computer Vision and Pattern Recognition · Computer Science 2018-09-10 Zhongyi Pei , Zhangjie Cao , Mingsheng Long , Jianmin Wang

Multi-source domain adaptation (DA) aims at leveraging information from more than one source domain to make predictions in a target domain, where different domains may have different data distributions. Most existing methods for…

Machine Learning · Statistics 2023-12-12 Yujie Wu , Giovanni Parmigiani , Boyu Ren

This paper introduces the Single-Cell Perturbation Prediction Diffusion Model (scPPDM), the first diffusion-based framework for single-cell drug-response prediction from scRNA-seq data. scPPDM couples two condition channels,…

Quantitative Methods · Quantitative Biology 2025-10-15 Zhaokang Liang , Shuyang Zhuang , Xiaoran Jiao , Weian Mao , Hao Chen , Chunhua Shen

Phenotype-based screening has attracted much attention for identifying cell-active compounds. Transcriptional and proteomic profiles of cell population or single cells are informative phenotypic measures of cellular responses to…

Quantitative Methods · Quantitative Biology 2023-11-20 Wei Huang , Aichun Zhu , Hui Liu

Domain adaptation aims to exploit the knowledge in source domain to promote the learning tasks in target domain, which plays a critical role in real-world applications. Recently, lots of deep learning approaches based on autoencoders have…

Machine Learning · Computer Science 2019-11-01 Shuai Yang , Hao Wang , Yuhong Zhang , Pei-Pei Li , Yi Zhu , Xuegang Hu

Robust prediction of molecular properties under extreme out-of-distribution (OOD) scenarios is a pivotal bottleneck in AI-driven drug discovery. Current scaffold-splitting protocols fail to obstruct microscopic semantic overlap,…

Machine Learning · Computer Science 2026-05-15 Zhuohao Lin , Kun Li , Jiameng Chen , Jiajun Yu , Duanhua Cao , Yizhen Zheng , Wenbin Hu
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