The underperformance of existing multimodal large language models for time series reasoning lies in the absence of rationale priors that connect temporal observations to their downstream outcomes, which leads models to rely on superficial pattern matching rather than principled reasoning. We therefore propose the rationale-grounded in-context learning for time series reasoning, where rationales work as guiding reasoning units rather than post-hoc explanations, and develop the RationaleTS method. Specifically, we firstly induce label-conditioned rationales, composed of reasoning paths from observable evidence to the potential outcomes. Then, we design the hybrid retrieval by balancing temporal patterns and semantic contexts to retrieve correlated rationale priors for the final in-context inference on new samples. We conduct extensive experiments to demonstrate the effectiveness and efficiency of our proposed RationaleTS on three-domain time series reasoning tasks. We provide the source code in https://github.com/yuppielqx/RationaleTS.

Goal-directed molecular generation requires satisfying heterogeneous constraints such as protein–ligand compatibility and multi-objective drug-like properties, yet existing methods often optimize these constraints in isolation, failing to reconcile conflicting objectives (e.g., affinity vs. safety), and struggle to navigate the non-differentiable chemical space without compromising structural validity. To address these challenges, we propose CAGenMol, a condition-aware discrete diffusion framework over molecular sequences that formulates molecular design as conditional denoising guided by heterogeneous structural and property signals. By coupling discrete diffusion with reinforcement learning, the model aligns the generation trajectory with non-differentiable objectives while preserving chemical validity and diversity. The non-autoregressive nature of diffusion language model further enables iterative refinement of molecular fragments at inference time. Experiments on structure-conditioned, property-conditioned, and dual-conditioned benchmarks demonstrate consistent improvements over state-of-the-art methods in binding affinity, drug-likeness, and success rate, highlighting the effectiveness of our framework. The code is available at https://github.com/Lee612-1/CAGenMol.