The accurate prediction of drug–target interactions is essential for drug discovery and development. However, current models often struggle with two challenges. First, they fail to model the directional flow and positional sensitivity of protein sequences, which are critical for identifying functional interaction regions. Second, they lack mechanisms to integrate multi-scale information from both local binding sites and broader structural context. To overcome these limitations, we propose CAMF-DTI, a novel framework that incorporates coordinate attention, multi-scale feature fusion, and cross-attention to enhance both the representation and interaction learning of drug and protein features. Drug molecules are represented as molecular graphs and encoded using graph convolutional networks, while protein sequences are processed with coordinate attention to preserve directional and spatial information. Multi-scale fusion modules are applied to both encoders to capture local and global features, and a cross-attention module integrates the representations to enable dynamic drug–target interaction modeling. We evaluate CAMF-DTI on four benchmark datasets: BindingDB, BioSNAP, C.elegans, and Human. Experimental results show that CAMF-DTI consistently outperforms seven state-of-the-art baselines in terms of AUROC, AUPRC, Accuracy, F1-score, and MCC. Ablation studies further confirm the effectiveness of each module, and visualization results demonstrate the model’s potential interpretability.
Tool use enables large language models (LLMs) to access external information, invoke software systems, and act in digital environments beyond what can be solved from model parameters alone. Early research mainly studied whether a model could select and execute a correct single tool call. As agent systems evolve, however, the focus has increasingly shifted from isolated invocation to multi-tool orchestration over long trajectories with intermediate state, execution feedback, changing environments, and practical constraints such as safety, cost, and verifiability. This survey reviews recent progress in multi-tool LLM agents and examines the principal research directions in this developing area. First, we unify task formulations and distinguish single-call tool use from long-horizon orchestration. Then, we organize the literature around six key dimensions: inference-time planning and execution, training and trajectory construction, safety and control, efficiency under resource constraints, capability completeness in open environments, and benchmark design and evaluation. We further summarize representative applications in software engineering, enterprise workflows, graphical user interfaces, and mobile systems. Finally, we discuss major challenges and outline future directions for building reliable, scalable, and verifiable multi-tool agents.