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Traditional Chinese Medicine (TCM) formulas play a significant role in treating epidemics and complex diseases. Existing models for TCM utilize traditional algorithms or deep learning techniques to analyze formula relationships, yet lack…

Computation and Language · Computer Science 2025-09-09 ZiXuan Zhang , Bowen Hao , Yingjie Li , Hongzhi Yin

Molecular property prediction is a crucial foundation for drug discovery. In recent years, pre-trained deep learning models have been widely applied to this task. Some approaches that incorporate prior biological domain knowledge into the…

Machine Learning · Computer Science 2024-08-20 Tianyu Zhang , Yuxiang Ren , Chengbin Hou , Hairong Lv , Xuegong Zhang

Molecular Property Prediction (MPP) is a fundamental problem in drug discovery that has recently attracted growing attention. Large Language Models (LLMs), known for their impressive proficiency across domains, show promise as generalist…

Machine Learning · Computer Science 2026-05-28 Khiem Le , Sreejata Dey , Marcos Martínez Galindo , Vanessa Lopez , Ting Hua , Nitesh V. Chawla , Hoang Thanh Lam

Large Language Models (LLMs) provide a possibility to make a great breakthrough in medicine. The establishment of a standardized medical benchmark becomes a fundamental cornerstone to measure progression. However, medical environments in…

Computation and Language · Computer Science 2024-04-05 Xidong Wang , Guiming Hardy Chen , Dingjie Song , Zhiyi Zhang , Zhihong Chen , Qingying Xiao , Feng Jiang , Jianquan Li , Xiang Wan , Benyou Wang , Haizhou Li

Deep Reinforcement Learning is widely used for aligning Large Language Models (LLM) with human preference. However, the conventional reward modelling is predominantly dependent on human annotations provided by a select cohort of…

Artificial Intelligence · Computer Science 2024-05-31 Dexun Li , Cong Zhang , Kuicai Dong , Derrick Goh Xin Deik , Ruiming Tang , Yong Liu

Traditional Chinese Medicine theory is built on imagistic thinking, in which medical principles and diagnostic and therapeutic logic are structured through metaphor and metonymy. However, existing English translations largely rely on…

Computation and Language · Computer Science 2025-12-16 Jiatong Han

Clinical trials are a systematic endeavor to assess the safety and efficacy of new drugs or treatments. Conducting such trials typically demands significant financial investment and meticulous planning, highlighting the need for accurate…

Machine Learning · Computer Science 2025-11-03 Tien Huu Do , Antoine Masquelier , Nae Eoun Lee , Jonathan Crowther

Current pharmaceutical formulation development still strongly relies on the traditional trial-and-error approach by individual experiences of pharmaceutical scientists, which is laborious, time-consuming and costly. Recently, deep learning…

Machine Learning · Computer Science 2018-12-05 Yilong Yang , Zhuyifan Ye , Yan Su , Qianqian Zhao , Xiaoshan Li , Defang Ouyang

Pre-trained Language Models (PLMs) have achieved remarkable performance gains across numerous downstream tasks in natural language understanding. Various Chinese PLMs have been successively proposed for learning better Chinese language…

Computation and Language · Computer Science 2022-09-16 Borun Chen , Hongyin Tang , Jiahao Bu , Kai Zhang , Jingang Wang , Qifan Wang , Hai-Tao Zheng , Wei Wu , Liqian Yu

Pre-training and fine-tuning have emerged as a promising paradigm across various natural language processing (NLP) tasks. The effectiveness of pretrained large language models (LLM) has witnessed further enhancement, holding potential for…

Computation and Language · Computer Science 2023-11-06 Guoxing Yang , Jianyu Shi , Zan Wang , Xiaohong Liu , Guangyu Wang

Domain-specific LLMs in TCM face limitations in research settings due to constrained adaptability, insufficient evaluation datasets, and limited computational resources. This study presents TianHui, a specialized TCM LLM built through…

Computation and Language · Computer Science 2025-10-24 Ji Yin , Menglan He , Yujie Zhang , Linshuai Zhang , Tingting Ma , Ce Tian , Jie Wu , Lin Xu , Tao Jiang

Traditional Chinese medicine (TCM) prescription is the most critical form of TCM treatment, and uncovering the complex nonlinear relationship between symptoms and TCM is of great significance for clinical practice and assisting physicians…

Computation and Language · Computer Science 2023-11-30 Hua Pu , Jiacong Mi , Shan Lu , Jieyue He

This paper details a technical plan for building a clinical case database for Traditional Chinese Medicine (TCM) using web scraping. Leveraging multiple platforms, including 360doc, we gathered over 5,000 TCM clinical cases, performed data…

Computation and Language · Computer Science 2024-11-26 Peng Xu , Hongjin Wu , Jinle Wang , Rongjia Lin , Liwei Tan

The tongue image provides important physical information of humans. It is of great importance for diagnoses and treatments in clinical medicine. Herbal prescriptions are simple, noninvasive and have low side effects. Thus, they are widely…

Computer Vision and Pattern Recognition · Computer Science 2022-01-07 Yang Hu , Guihua Wen , Huiqiang Liao , Changjun Wang , Dan Dai , Zhiwen Yu

Large language models (LLMs) holds significant promise in achieving general medication recommendation systems owing to their comprehensive interpretation of clinical notes and flexibility to medication encoding. We evaluated both…

Information Retrieval · Computer Science 2025-08-05 Zihao Zhao , Chenxiao Fan , Junlong Liu , Zheng Wang , Xiangnan He , Chongming Gao , Juan Li , Fuli Feng

Drug repositioning (DR) refers to identification of novel indications for the approved drugs. The requirement of huge investment of time as well as money and risk of failure in clinical trials have led to surge in interest in drug…

Computation and Language · Computer Science 2017-05-23 Sahil Manchanda , Ashish Anand

Traditional Chinese medicine, as an essential component of traditional medicine, contains active ingredients that serve as a crucial source for modern drug development, holding immense therapeutic potential and development value. A…

Machine Learning · Computer Science 2025-05-02 Leifeng Zhang , Xin Dong , Shuaibing Jia , Jianhua Zhang

Traditional Chinese medicine (TCM) exhibits remarkable therapeutic efficacy in healthcare through patient-specific formulas. However, current AI-based TCM formula recommendation models and methods mainly focus on data-based textual…

Machine Learning · Computer Science 2026-04-15 Xinhan Zheng , Xueting Wang , Ruotai Li , Huyu Wu , Haopeng Jin , Yehan Yang , Guodong Shan

The practice of Traditional Chinese Medicine (TCM) requires profound expertise and extensive clinical experience. While Large Language Models (LLMs) offer significant potential in this domain, current TCM-oriented LLMs suffer two critical…

Computation and Language · Computer Science 2026-01-21 Yehan Yang , Tianhao Ma , Ruotai Li , Xinhan Zheng , Guodong Shan

Metaphorical expressions are abundant in Traditional Chinese Medicine (TCM), conveying complex disease mechanisms and holistic health concepts through culturally rich and often abstract terminology. Bridging these metaphors to anatomically…

Computation and Language · Computer Science 2025-03-05 Jiacheng Tang , Nankai Wu , Fan Gao , Chengxiao Dai , Mengyao Zhao , Xinjie Zhao