activity
20122026
most cited14 Examples of How LLMs Can Transform Materials Science and Chemistry: A Reflection on a Large Language Model Hackathon

214 citations · 461 across the 18 of their papers we have counts for

collaborators
Showing 2025Show all

5 papers · 1 filter

q-bio.QM2025

Graph AI generates neurological hypotheses validated in molecular, organoid, and clinical systems

Ayush Noori, Joaquín Polonuer, Katharina Meyer +26

Neurological diseases are the leading global cause of disability, yet most lack disease-modifying treatments. We present PROTON, a heterogeneous graph transformer that generates te…

cs.AI2025★ 14 cited

Kosmos: An AI Scientist for Autonomous Discovery

Ludovico Mitchener, Angela Yiu, Benjamin Chang +34

Data-driven scientific discovery requires iterative cycles of literature search, hypothesis generation, and data analysis. Substantial progress has been made towards AI agents that…

cs.LG2025★ 10 cited

Training a Scientific Reasoning Model for Chemistry

Siddharth M. Narayanan, James D. Braza, Ryan-Rhys Griffiths +6

Reasoning models are large language models that emit a long chain-of-thought before answering, providing both higher accuracy and explicit reasoning for their response. A major que…

cs.AI2025★ 9 cited

Robin: A multi-agent system for automating scientific discovery

Ali Essam Ghareeb, Benjamin Chang, Ludovico Mitchener +7

Scientific discovery is driven by the iterative process of background research, hypothesis generation, experimentation, and data analysis. Despite recent advancements in applying a…

q-bio.QM2025★ 14 cited

BixBench: a Comprehensive Benchmark for LLM-based Agents in Computational Biology

Ludovico Mitchener, Jon M Laurent, Alex Andonian +6

Large Language Models (LLMs) and LLM-based agents show great promise in accelerating scientific research. Existing benchmarks for measuring this potential and guiding future develo…