new

Get trending papers in your email inbox!

Subscribe

Daily Papers

byAK and the research community

Aug 21

Deep Academic Survey: Stateful Agentic Closed-Loop Paradigm for Academic Survey Automation

Academic surveys play a central role in organizing rapidly expanding scholarly literature, yet their construction requires extensive paper analysis, coherent knowledge organization, fine-grained citation support, and reliable manuscript assembly. Existing Deep Research and automated survey generation systems address parts of this process, but typically do not coordinate paper understanding, literature organization, evidence-grounded drafting, and manuscript validation through a shared, revisable state. We introduce DAS, a stateful agentic framework for generating publication-oriented academic surveys. Its key idea is to separate reusable paper analysis from topic-specific manuscript construction. DAS builds on DAS-2M, a dynamically updated metadata lake containing survey-oriented representations of approximately two million papers. Its agents maintain explicit literature, organization, writing, and finalization states through candidate-grounded taxonomy planning, reverse paper-to-section routing, and hierarchical claim and citation planning. Semantic review reactivates only the affected writing states for repair and reevaluation, forming a scoped closed loop with deterministic validation. We further introduce DAS-Bench, a 30-topic benchmark, together with DAS-Eval, which assesses scholarly citation quality, taxonomic synthesis, hierarchical discourse, and manuscript assembly reliability through 16 criteria. Among systems evaluated on all 30 topics, DAS achieves the highest average in all four dimensions, with an overall score of 4.34 compared with 4.03 for the strongest competitor, and the same ordering is preserved on the matched 21-topic CS subset. Blinded expert evaluation further prefers DAS to Naive RAG on 27 of 30 topics and to AutoSurvey on 19 of 21 shared CS topics. The project page is available at https://zhikaixu24.github.io/projects/DAS/.

  • 6 authors
·
Aug 17

GemNet-OC: Developing Graph Neural Networks for Large and Diverse Molecular Simulation Datasets

Recent years have seen the advent of molecular simulation datasets that are orders of magnitude larger and more diverse. These new datasets differ substantially in four aspects of complexity: 1. Chemical diversity (number of different elements), 2. system size (number of atoms per sample), 3. dataset size (number of data samples), and 4. domain shift (similarity of the training and test set). Despite these large differences, benchmarks on small and narrow datasets remain the predominant method of demonstrating progress in graph neural networks (GNNs) for molecular simulation, likely due to cheaper training compute requirements. This raises the question -- does GNN progress on small and narrow datasets translate to these more complex datasets? This work investigates this question by first developing the GemNet-OC model based on the large Open Catalyst 2020 (OC20) dataset. GemNet-OC outperforms the previous state-of-the-art on OC20 by 16% while reducing training time by a factor of 10. We then compare the impact of 18 model components and hyperparameter choices on performance in multiple datasets. We find that the resulting model would be drastically different depending on the dataset used for making model choices. To isolate the source of this discrepancy we study six subsets of the OC20 dataset that individually test each of the above-mentioned four dataset aspects. We find that results on the OC-2M subset correlate well with the full OC20 dataset while being substantially cheaper to train on. Our findings challenge the common practice of developing GNNs solely on small datasets, but highlight ways of achieving fast development cycles and generalizable results via moderately-sized, representative datasets such as OC-2M and efficient models such as GemNet-OC. Our code and pretrained model weights are open-sourced.

  • 7 authors
·
Apr 6, 2022