Large Language Models for Zero-shot Inference of Causal Structures in Biology
Journal:
arXiv
Published Date:
Mar 6, 2025
Abstract
Genes, proteins and other biological entities influence one another via
causal molecular networks. Causal relationships in such networks are mediated
by complex and diverse mechanisms, through latent variables, and are often
specific to cellular context. It remains challenging to characterise such
networks in practice. Here, we present a novel framework to evaluate large
language models (LLMs) for zero-shot inference of causal relationships in
biology. In particular, we systematically evaluate causal claims obtained from
an LLM using real-world interventional data. This is done over one hundred
variables and thousands of causal hypotheses. Furthermore, we consider several
prompting and retrieval-augmentation strategies, including large, and
potentially conflicting, collections of scientific articles. Our results show
that with tailored augmentation and prompting, even relatively small LLMs can
capture meaningful aspects of causal structure in biological systems. This
supports the notion that LLMs could act as orchestration tools in biological
discovery, by helping to distil current knowledge in ways amenable to
downstream analysis. Our approach to assessing LLMs with respect to
experimental data is relevant for a broad range of problems at the intersection
of causal learning, LLMs and scientific discovery.
