AutoSci: A Memory-Centric Agentic System for the Full Scientific Research Lifecycle

Scientific research has traditionally been human-intensive, requiring researchers to coordinate literature, ideas, experiments, manuscripts, and review responses across long project cycles. The rise of LLM-based scientific agents creates an opportunity to automate this process. Such a system must support the full research lifecycle, maintain structured persistent memory across projects, and improve its own research procedures over time. However, existing systems either partially satisfy or fail to satisfy these requirements, leaving a gap for a unified automated scientific research system. As a result, we present AutoSci, a memory-centric agentic system for the full scientific research lifecycle. AutoSci is organized around four modules. SciMem provides schema-governed research memory, separating Long-Term Knowledge Memory for reusable scientific knowledge from Active Research Memory for project-level artifacts such as ideas, experiments, manuscripts, and reviews. SciFlow executes a five-stage lifecycle from literature understanding to rebuttal through a harness that controls state, context, verification, feedback, and orchestration. SciDAG augments difficult skills with DAG-shaped multi-agent operators and reusable stage-specific templates. SciEvolve converts feedback signals from users, experiments, reviews, and external environments into versioned updates to SciMem organization, SciFlow skills, and SciDAG templates. Together, these modules make AutoSci a persistent research environment that can execute, remember, and evolve across research projects. The code repository is available at https://github.com/skyllwt/AutoSci.

LB-MCTS: Synergizing Large Language Models and Bayesian Optimization for Efficient CASH

To lower the expertise barrier in machine learning, the AutoML community has focused on the CASH problem, a fundamental challenge that automates the process of algorithm selection and hyperparameter tuning. While traditional methods like Bayesian Optimization (BO) struggle with cold-start issues, Large Language Models (LLMs) can mitigate these via semantic priors. However, existing LLM-based optimizers generalize poorly to the high-dimensional, structured CASH space. We propose LB-MCTS, a framework synergizing LLMs and BO within a Monte Carlo Tree Search structure. It maximizes LLM reasoning with Selective Tuning Memory (STM) and explicit exploration-exploitation trade-off. It combines the strengths of both paradigms by dynamically shifting from LLM-driven to BO-driven proposals as data accumulates. Experiments on 104 AMLB datasets demonstrate the superiority of LB-MCTS over the competitive baselines.