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Beyond Pairwise Interactions: Equivariant Hypergraph Diffusion for Crystal Structure Prediction
Announce Type: replace Abstract: Crystal Structure Prediction (CSP) remains a fundamental challenge with significant implications for materials discovery and the advancement of various scientific disciplines. Recent advances have demonstrated that generative models, particularly diffusion models, are especially promising for CSP.
Does Artificial Intelligence Advance Science?
arXiv:2606.05118v1 Announce Type: new Abstract: This paper examines whether and how artificial intelligence (AI) advances scientific creativity. Drawing on scientific publications, the primary output of researchers, we analyze over one million publications from OpenAlex to investigate the relationship between AI adoption and multiple dimensions of scientific creativity, including novelty (recombinant novelty and object novelty) and impact (3-year short-run citation impact and 10-year...
SIGA: Self-Evolving Coding-Agent Adapters for Scientific Simulation
arXiv:2606.09774v1 Announce Type: new Abstract: Advanced scientific simulators expose specialized input languages that turn simulation goals into executable configurations, but learning them can cost domain scientists hours to days. We study simulator setup as a problem of agent-tool interface grounding: what minimal simulator-specific adaptations are needed for an off-the-shelf coding agent to operate real scientific software?
Declines in research funding and science ecosystem fragility
arXiv:2606.09387v1 Announce Type: new Abstract: Scientific knowledge advances through within-country and cross-border scientific activities and collaborations, influenced by funding and strength of research enterprise. Sudden declines in research funding, for example from Federal sources in the United States (US) 2024-25, adversely impact on scientific collaboration. How rapid declines in funding affect the science enterprise and the magnitude of impact need to be analysed.
Declines in research funding and science ecosystem fragility
arXiv:2606.09387v1 Announce Type: cross Abstract: Scientific knowledge advances through within-country and cross-border scientific activities and collaborations, influenced by funding and strength of research enterprise. Sudden declines in research funding, for example from Federal sources in the United States (US) 2024-25, adversely impact on scientific collaboration. How rapid declines in funding affect the science enterprise and the magnitude of impact need to be analysed.
Tree-Structured Parzen Estimator: Understanding Its Algorithm Components and Their Roles for Better Empirical Performance
arXiv:2304.11127v5 Announce Type: replace Abstract: Recent scientific advances require complex experiment design, necessitating the meticulous tuning of many experiment parameters. Tree-structured Parzen estimator (TPE) is a widely used Bayesian optimization method in recent parameter tuning frameworks such as Hyperopt and Optuna. Despite its popularity, the roles of each control parameter in TPE and the algorithm intuition have not been discussed so far.
First-of-its-kind AI tool for translating life-saving weather warnings across the US advanced
First-of-its-kind AI tool for translating life-saving weather warnings across the US advanced Gaby Clark Scientific Editor Andrew Zinin Lead Editor Nearly 69 million people in the United States speak a language other than English at home, yet weather warnings have long been issued almost exclusively in English. A new study documents how the National Weather Service is using artificial intelligence to change that, developing a comprehensive translation program that delivers life-saving...
Symbolic Regression for Shared Expressions: Introducing Partial Parameter Sharing
arXiv:2601.04051v3 Announce Type: replace Abstract: Symbolic regression aims to find symbolic expressions that describe datasets. Due to its inherent interpretability, symbolic regression (SR) is a powerful paradigm for scientific discovery. Recent advances have expanded SR to describe related phenomena using a single expression with varying sets of parameters, thereby introducing a single categorical variable.
Chip-scale 'acoustic atom' controls sound waves to imitate atomic energy levels and advance computing
Chip-scale 'acoustic atom' controls sound waves to imitate atomic energy levels and advance computing Stephanie Baum Scientific Editor Robert Egan Associate Editor For every action, there is an equal and opposite reaction. What goes up must come down. Physical laws like these govern all of the natural world—except for the tiny internal components of today's microprocessors, which operate according to the unique and complicated rules of quantum physics.
Teams of AI agents boost speed of research
Teams of AI agents are significantly accelerating the pace of scientific research. These advanced systems are capable of generating novel hypotheses, interpreting complex data sets, and suggesting viable pathways for drug development.